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ChemicalBook--->CAS DataBase List--->1169562-71-3

1169562-71-3

1169562-71-3 Structure

1169562-71-3 Structure
IdentificationBack Directory
[Name]

XL413 (BMS-863233)
[CAS]

1169562-71-3
[Synonyms]

CS-1062
XL413.HCL
1169562-71-3
BMS-863233 HCl
XL413(BMS-863233)
BMS-863233 HCl salt
BMS-863233 (XL-413)
XL413 (hydrochloride)
XL413 (BMS-863233) HCl
BMS-863233 HCl (XL-413)
BMS-863233 Hydrochloride
XL413 (BMS-863233) USP/EP/BP
XL 413 hydrochloride - BMS 863233 hydrochloride
BMS-863233; BMS863233; BMS 863233; XL-413; XL413; XL 413.
8-Chloro-2-(2S)-2-pyrrolidinylbenzofuro[3,2-d]pyrimidin-4(3H)-one hydrochloride
(S)-8-Chloro-2-(pyrrolidin-2-yl)benzofuro[3,2-d]pyrimidin-4(3H)-one xhydrochloride
Benzofuro[3,2-d]pyrimidin-4(3H)-one, 8-chloro-2-(2S)-2-pyrrolidinyl-, hydrochloride
8-Chloro-2-(2S)-2-pyrrolidinylbenzofuro[3,2-d]pyrimidin-4(3H)-one hydrochloride (1:?)
Benzofuro[3,2-d]pyriMidin-4(3H)-one, 8-chloro-2-(2S)-2-pyrrolidinyl-, (Hydrochloride) (1:)
(4AR,6S,7R,7AS)-6-[4-[[(1S)-2,3-DIHYDRO-1H-INDEN-1-YL]AMINO]PYRROLO[2,3-D]PYRIMIDIN-7-YL]-2-(4-METHOXYPHENYL)-4,4A,5,6,7,7A-HEXAHYDROCYCLOPENTA[D][1,3]DIOXIN-7-OL
[Molecular Formula]

C14H12ClN3O2.x(HCl)
[MDL Number]

MFCD28023577
[MOL File]

1169562-71-3.mol
[Molecular Weight]

326.178
Chemical PropertiesBack Directory
[storage temp. ]

-20°C
[solubility ]

DMSO: Insoluble;Ethanol: Insoluble
[form ]

powder
[color ]

white to beige
[Water Solubility ]

Water: 46 mg/mL (141.03 mM)
[Stability:]

Hygroscopic
Safety DataBack Directory
[Symbol(GHS) ]


GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P301+P310+P330
[RIDADR ]

UN 2811 6.1 / PGIII
Hazard InformationBack Directory
[Uses]

XL413 is a potent and selective cell division cycle 7 homolog (CDC7) kinase inhibitor.
[Biological Activity]

XL413 hydrochloride is a potent and selective cell division cycle 7 homolog (CDC7) kinase inhibitor with IC50 of 3.4 nM, its selectivity over CK2, Pim-1 and pMCM2 are 63-, 12- and 35-fold. Phase 1/2.
[in vitro]

In MDA-MB-231T and Colo-205 cell lines,XL413 hydrochloride inhibits CDC7-specific phosphorylation of MCM2. XL413 also inhibited cell proliferation in Colo-205 cells, decreased cell viability, and stimulated caspase 3/7 activity. Furthermore, XL413 resulted in altered S-phase progression and subsequent apoptosis.
[in vivo]

In the Colo-205 xenograft model, XL413, at a dose of 3 mg/kg, inhibited 70% of phosphorylated MCM2 and caused significant regression of tumor growth at a dose of 100 mg/kg.
[target]

< td style="border-bottom: 1px dotted #ccc;padding: 5px;"> CK2
(Cell-free assay)
TargetValue
Cdc7
(Cell-free assay)
3.4 nM
Pim1
(Cell-free assay)
42 nM
212 nM
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

XL413 (BMS-863233)(1169562-71-3)1HNMR
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