成人免费xx,国产又黄又湿又刺激不卡网站,成人性视频app菠萝网站,色天天天天

Home Cart 0 Sign in  

[ CAS No. 190728-25-7 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
Chemical Structure| 190728-25-7
Chemical Structure| 190728-25-7
Structure of 190728-25-7 * Storage: {[proInfo.prStorage]}

Please Login or Create an Account to: See VIP prices and availability

Cart0 Add to My Favorites Add to My Favorites Bulk Inquiry Inquiry Add To Cart

Search after Editing

* Storage: {[proInfo.prStorage]}

* Shipping: {[proInfo.prShipping]}

Quality Control of [ 190728-25-7 ]

Related Doc. of [ 190728-25-7 ]

Alternatived Products of [ 190728-25-7 ]
Product Citations

Product Details of [ 190728-25-7 ]

CAS No. :190728-25-7 MDL No. :MFCD19685633
Formula : C17H16N2O3 Boiling Point : -
Linear Structure Formula :- InChI Key :VXEQRXJATQUJSN-UHFFFAOYSA-N
M.W : 296.32 Pubchem ID :11594543
Synonyms :
Chemical Name :4-((6,7-Dimethoxyquinolin-4-yl)oxy)aniline

Calculated chemistry of [ 190728-25-7 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 22
Num. arom. heavy atoms : 16
Fraction Csp3 : 0.12
Num. rotatable bonds : 4
Num. H-bond acceptors : 4.0
Num. H-bond donors : 1.0
Molar Refractivity : 85.65
TPSA : 66.6 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : Yes
CYP1A2 inhibitor : Yes
CYP2C19 inhibitor : Yes
CYP2C9 inhibitor : Yes
CYP2D6 inhibitor : Yes
CYP3A4 inhibitor : Yes
Log Kp (skin permeation) : -5.99 cm/s

Lipophilicity

Log Po/w (iLOGP) : 2.71
Log Po/w (XLOGP3) : 2.98
Log Po/w (WLOGP) : 3.63
Log Po/w (MLOGP) : 1.62
Log Po/w (SILICOS-IT) : 2.84
Consensus Log Po/w : 2.76

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 0.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -3.83
Solubility : 0.044 mg/ml ; 0.000148 mol/l
Class : Soluble
Log S (Ali) : -4.04
Solubility : 0.0269 mg/ml ; 0.0000908 mol/l
Class : Moderately soluble
Log S (SILICOS-IT) : -5.84
Solubility : 0.000423 mg/ml ; 0.00000143 mol/l
Class : Moderately soluble

Medicinal Chemistry

PAINS : 1.0 alert
Brenk : 1.0 alert
Leadlikeness : 0.0
Synthetic accessibility : 2.33

Safety of [ 190728-25-7 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P305+P351+P338 UN#:N/A
Hazard Statements:H302-H315-H319-H335 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 190728-25-7 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 190728-25-7 ]

[ 190728-25-7 ] Synthesis Path-Downstream   1~7

  • 1
  • [ 190728-25-7 ]
  • [ 32315-10-9 ]
  • [ 367-34-0 ]
  • [ 144-55-8 ]
  • N-(2,4,5-trifluorophenyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}urea [ No CAS ]
YieldReaction ConditionsOperation in experiment
73% With triethylamine; In toluene; Example 219 N-(2,4,5-Trifluorophenyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}urea [255] 6,7-Dimethoxy-4-(4-aminophenoxy)quinoline (50 mg) was dissolved in toluene (5 ml) with heat, after the addition of triethylamine (1 ml), triphosgene (55 mg) was added, and the admixture was refluxed with heat for 3 minutes. <strong>[367-34-0]2,4,5-Trifluoroaniline</strong> (75 mg) was added to the reaction mixture, and the admixture was refluxed with heat for 20 minutes. After the addition of aqueous sodium hydrogen carbonate, the reaction mixture was extracted 2 times with ethyl acetate, and the organic layer was then washed with brine and dried with anhydrous sodium sulfate. The solvent was removed by reduced-pressure distillation, and the resulting residue was purified by column chromatography on silica gel eluding with chloroform/acetone (10/1) to obtain 58 mg of the title compound (yield: 73percent). 1 H-NMR (DMSO-d6, 500 MHz): delta 3.94 (s, 3H), 3.95 (s, 3H), 6.45 (d, J=5.5Hz, 1H), 7.24 (d, J=8.6Hz, 2H), 7.40 (s, 1H), 7.52 (s, 1H), 7.59 (d, J=8.6Hz, 2H), 7.62~7.70 (m, 1H), 8.17~8.25 (m, 1H), 8.48 (d, J=4.9Hz, 1H), 8.76 (s, 1H), 9.23 (s, 1H) Mass spectrometry data (FD-MS, m/z): 469 (M+)
  • 2
  • [ 190728-25-7 ]
  • [ 32315-10-9 ]
  • [ 6299-67-8 ]
  • [ 144-55-8 ]
  • N-(2,3-Dimethoxyphenyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}urea [ No CAS ]
YieldReaction ConditionsOperation in experiment
100% With triethylamine; In toluene; Example 232 N-(2,3-Dimethoxyphenyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}urea [268] 6,7-Dimethoxy-4-(4-aminophenoxy)quinoline (52 mg) was dissolved in toluene (5 ml) with heat, after the addition of triethylamine (1 ml), triphosgene (74 mg) was added, and the admixture was refluxed with heat for 3 minutes. 2,3-Dimethoxyaniline (0.05 ml) was added to the reaction mixture, and the admixture was refluxed with heat for 11 minutes. After the addition of aqueous sodium hydrogen carbonate, the reaction mixture was extracted 2 times with ethyl acetate, and the organic layer was then washed with brine and dried with anhydrous sodium sulfate. The solvent was removed by reduced-pressure distillation, and the resulting residue was purified by column chromatography on silica gel eluding with chloroform/acetone (10/1) to obtain 83 mg of the title compound (yield: 100%). 1 H-NMR (CDCl3, 500 MHz): (3.72 (s, 3H), 3.84 (s, 3H), 4.02 (s, 3H), 4.05 (s, 3H), 6.46 (d, J=5.5Hz, 1H), 6.62 (d, J=7.9Hz, 1H), 7.05 (dd, J=8.5, 8.5Hz, 1H), 7.13 (d, J=9.2Hz, 2H), 7.43 (s, 1H), 7.54 (d, J=8.6Hz, 2H), 7.58 (s, 1H), 7.85 (d, J=8.6Hz, 1H), 7.88 (s, 1H), 8.27 (s, 1H), 8.50 (d, J=5.5Hz, 1H) Mass spectrometry data (FD-MS, m/z): 475 (M+)
  • 3
  • [ 190728-25-7 ]
  • [ 32315-10-9 ]
  • [ 32202-61-2 ]
  • [ 144-55-8 ]
  • N-(5-Indanyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}urea [ No CAS ]
YieldReaction ConditionsOperation in experiment
16% In toluene; Example 114 N-(5-Indanyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]phenyl}urea [197] 6,7-Dimethoxy-4-(4-aminophenoxy)quinoline (51 mg) was suspended in toluene (5 ml), triphosgene (54 mg) was added, and the admixture was refluxed with heat for 12 minutes. <strong>[32202-61-2]4-Aminoindan</strong> (36 mg) was added, and the admixture was refluxed with heat for 36 minutes. After the addition of aqueous sodium hydrogen carbonate, the reaction mixture was extracted 2 times with ethyl acetate, and the organic layer was then washed with brine and dried with anhydrous sodium sulfate. The solvent was removed by reduced-pressure distillation and the resulting residue was purified by column chromatography on silica gel eluding with chloroform/acetone (10/1) to obtain 13 mg of the title compound (yield: 16percent). 1 H-NMR (CDCl3, 500 MHz): delta 2.04 (m, 2H), 2.82~2.86 (m, 4H), 4.01 (s, 3H), 4.03 (s, 3H), 6.40 (d, J=5.5 Hz, 1H), 7.03 (m, 1H), 7.08 (d, J=8.5 Hz, 2H), 7.13 (m, 1H), 7.32 (s, 1H), 7.40~7.57 (m, 6H), 8.44 (d, J=4.9 Hz, 1H) Mass spectrometry data (FD-MS, m/z): 455 (M+)
  • 4
  • [ 190728-25-7 ]
  • [ 32315-10-9 ]
  • [ 120121-01-9 ]
  • 1-(3-Chlorophenyl)ethyl N-{4-((6,7-dimethoxy-4-quinazolinyl)oxy)phenyl}carbamate [ No CAS ]
YieldReaction ConditionsOperation in experiment
70% With triethylamine; In methanol; dichloromethane; chloroform; water; toluene; Example 3 1-(3-Chlorophenyl)ethyl N-{4-((6,7-dimethoxy-4-quinazolinyl)oxy)phenyl}carbamate 4-[(6,7-Dimethoxy-4-quinolyl)oxy]aniline (72 mg) was added to toluene/triethylamine = 10/1 (8 ml), and the mixture was heated under reflux to prepare a solution. A solution of triphosgene (109 mg) in methylene chloride was then added to the solution, and the mixture was heated under reflux for 15 min. Subsequently, 3-chloro-alpha-methylbenzyl alcohol (46 mg) was added thereto, and the mixture was further stirred with heating under reflux for 2 hr. After the completion of the reaction, the reaction solution was allowed tocool to room temperature before distilled water was added thereto. The mixture was subjected to separatory extraction with chloroform, followed by washing with a 1 N aqueous hydrochloric acid solution and saturated brine. The washed solution was dried over sodium sulfate and was concentrated. The residue was purified on a column using chloroform/methanol to give the title compound (88 mg, yield 70%). 1H-NMR (CDCl3, 400 MHz): 8.44 - 8.50 (1H, m), 8.14 (1H, s), 7.58 - 7.64 (3H, m), 7.26 - 7.42 (4H, m), 7.15 - 7.19 (2H, m), 6.86 (1H, s), 6.67 (1H, d, J = 6.6), 5.88 (1H, q, J = 6.6), 4.16
  • 5
  • [ 190728-25-7 ]
  • [ 54-60-4 ]
  • [ 1207980-99-1 ]
YieldReaction ConditionsOperation in experiment
With N-ethyl-N,N-diisopropylamine; HATU; In dichloromethane; at 20℃; 4-(6,7-Dimethoxyquinolin-4-yloxy)benzenamine (60 mg, 202 μmol), 2-(4- fluorophenylamino)benzoic acid (56 mg, 243 μmol), and HATU (108 mg, 283 μmol) were combined in a resealable tube. DCM (1012 μl, 202 μmol) and N-ethyl-N- isopropylpropan-2-amine (71 μl, 405 μmol) were added, and the reaction mixture in the tube was allowed to stir at RT. Upon completion (as judged by LCMS), the reaction mixture was concentrated in vacuo, dissolved in minimal DMSO and purified by preparative HPLC {15-85% (0.1% TFA in CH3CN) in H2O over 20 min}. Fractions containing pure product were combined and neutralized with saturated aqueous NaHCO3 then extracted with EtOAc, dried over MgSO4, filtered, and concentrated in vacuo to afford pure N-(4-(6,7-dimethoxyquinolin-4-yloxy)phenyl)-2-(4- fluorophenylamino)benzamide as a off-white solid. MS Calcd for C3oH24FN3θ4: [M]+ = 509. Found: [M+H]+= 510.
  • 6
  • [ 190728-25-7 ]
  • [ 6914-71-2 ]
  • methyl 1-((4-((6,7-dimethoxyquinolin-4-yl)oxy)phenyl)carbamoyl)cyclopropane-1-carboxylate [ No CAS ]
YieldReaction ConditionsOperation in experiment
90.5% With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 20℃; for 2h; 4 - ((6. 7 -methoxy -4 - 1 -based) phenoxy) aniline 100 ml 5 2h (11.4g 0.039 muM, 1.0 1 8.6g 0.055 muM 1.4 100 ml 0 C 2 M 0.2 muMAt the end of the reaction, a purified unitz 800 ml stirred crystallization 5~6h, was added. Filter, filter cake, and 20 ml washing, gave 1 - ((4 - ((6, 7 -dimethoxyquinoline -4 -yloxy) phenyl) carbamoyl) cyclopropanecarboxylic acid methyl 14.7g, Bunit_ID, and purity Kunitz. 90.5%. 'unitz 99.8%'.
  • 7
  • [ 190728-25-7 ]
  • [ 22902-86-9 ]
  • 2-(4-chloro-3-(trifluoromethyl)phenyl)-N-(4-((6,7-dimethoxyquinolin-4-yl)oxy)phenyl)acetamide [ No CAS ]
Recommend Products
Same Skeleton Products

Technical Information

Historical Records

Related Functional Groups of
[ 190728-25-7 ]

Aryls

Chemical Structure| 749922-34-7

[ 749922-34-7 ]

7-(Benzyloxy)quinolin-4-ol

Similarity: 0.96

Chemical Structure| 131802-60-3

[ 131802-60-3 ]

7-(Benzyloxy)quinoline

Similarity: 0.93

Chemical Structure| 52057-98-4

[ 52057-98-4 ]

6-(4-Methoxyphenyl)pyridin-3-amine

Similarity: 0.79

Chemical Structure| 178984-56-0

[ 178984-56-0 ]

7-(Benzyloxy)-4-chloroquinoline

Similarity: 0.77

Chemical Structure| 343788-51-2

[ 343788-51-2 ]

8-(Benzyloxy)-2-chloroquinoline

Similarity: 0.74

Ethers

Chemical Structure| 749922-34-7

[ 749922-34-7 ]

7-(Benzyloxy)quinolin-4-ol

Similarity: 0.96

Chemical Structure| 13425-93-9

[ 13425-93-9 ]

6,7-Dimethoxyquinolin-4-ol

Similarity: 0.94

Chemical Structure| 131802-60-3

[ 131802-60-3 ]

7-(Benzyloxy)quinoline

Similarity: 0.93

Chemical Structure| 23432-39-5

[ 23432-39-5 ]

6-Methoxyquinolin-4-ol

Similarity: 0.91

Chemical Structure| 4964-76-5

[ 4964-76-5 ]

7-Methoxyquinoline

Similarity: 0.86

Amines

Chemical Structure| 87199-83-5

[ 87199-83-5 ]

7-Methoxyquinolin-3-amine

Similarity: 0.81

Chemical Structure| 90-52-8

[ 90-52-8 ]

8-Amino-6-methoxyquinoline

Similarity: 0.80

Chemical Structure| 52057-98-4

[ 52057-98-4 ]

6-(4-Methoxyphenyl)pyridin-3-amine

Similarity: 0.79

Chemical Structure| 1261810-14-3

[ 1261810-14-3 ]

7-Aminoquinolin-3-ol

Similarity: 0.73

Chemical Structure| 70125-16-5

[ 70125-16-5 ]

2-Amino-8-quinolinol

Similarity: 0.71

Related Parent Nucleus of
[ 190728-25-7 ]

Quinolines

Chemical Structure| 749922-34-7

[ 749922-34-7 ]

7-(Benzyloxy)quinolin-4-ol

Similarity: 0.96

Chemical Structure| 13425-93-9

[ 13425-93-9 ]

6,7-Dimethoxyquinolin-4-ol

Similarity: 0.94

Chemical Structure| 131802-60-3

[ 131802-60-3 ]

7-(Benzyloxy)quinoline

Similarity: 0.93

Chemical Structure| 23432-39-5

[ 23432-39-5 ]

6-Methoxyquinolin-4-ol

Similarity: 0.91

Chemical Structure| 4964-76-5

[ 4964-76-5 ]

7-Methoxyquinoline

Similarity: 0.86

; ;