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[ CAS No. 24259-59-4 ] {[proInfo.proName]}

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Chemical Structure| 24259-59-4
Chemical Structure| 24259-59-4
Structure of 24259-59-4 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 24259-59-4 ]

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Product Details of [ 24259-59-4 ]

CAS No. :24259-59-4 MDL No. :MFCD00167010
Formula : C5H10O5 Boiling Point : -
Linear Structure Formula :CH2OH(CHOH)3CHO InChI Key :PYMYPHUHKUWMLA-MROZADKFSA-N
M.W : 150.13 Pubchem ID :90428
Synonyms :
Chemical Name :(2S,3S,4S)-2,3,4,5-Tetrahydroxypentanal

Calculated chemistry of [ 24259-59-4 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 10
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.8
Num. rotatable bonds : 4
Num. H-bond acceptors : 5.0
Num. H-bond donors : 4.0
Molar Refractivity : 31.0
TPSA : 97.99 ?2

Pharmacokinetics

GI absorption : Low
BBB permeant : No
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -8.86 cm/s

Lipophilicity

Log Po/w (iLOGP) : -0.76
Log Po/w (XLOGP3) : -2.32
Log Po/w (WLOGP) : -2.74
Log Po/w (MLOGP) : -2.48
Log Po/w (SILICOS-IT) : -1.29
Consensus Log Po/w : -1.92

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 2.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : 0.95
Solubility : 1350.0 mg/ml ; 9.01 mol/l
Class : Highly soluble
Log S (Ali) : 0.8
Solubility : 944.0 mg/ml ; 6.29 mol/l
Class : Highly soluble
Log S (SILICOS-IT) : 1.94
Solubility : 13000.0 mg/ml ; 86.9 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 2.81

Safety of [ 24259-59-4 ]

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

Application In Synthesis of [ 24259-59-4 ]

* 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 [ 24259-59-4 ]

[ 24259-59-4 ] Synthesis Path-Downstream   1~5

  • 1
  • [ 67-56-1 ]
  • [ 75-52-5 ]
  • [ 533-49-3 ]
  • [ 124-41-4 ]
  • [ 24259-59-4 ]
  • [ 5328-37-0 ]
  • 2
  • [ 50-69-1 ]
  • [ 24259-59-4 ]
  • [ 50-69-1 ]
  • 3
  • [ 24259-59-4 ]
  • [ 873389-62-9 ]
  • 1-(6-ethoxycarbonylamino-3.4-dimethyl-anilino)-L-1-deoxy-ribitol [ No CAS ]
  • 4
  • [ 24259-59-4 ]
  • [ 488-81-3 ]
  • 5
  • [ 24259-59-4 ]
  • [ 78184-43-7 ]
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Reason: Stable Isotope

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