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1805833-75-3

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1805833-75-3 Structure

1805833-75-3 Structure
IdentificationBack Directory
[Name]

3-Piperidinol, 4-[[[3-(1-methylethyl)-7-[(phenylmethyl)amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]-, (3R,4R)-
[CAS]

1805833-75-3
[Synonyms]

CT7001)
PPDA-001
ICEC-0942
Samuraciclib
ICEC 0942 (ICEC0942
ICEC0942 (CT7001) Free base
Samuraciclib (Synonyms: CT7001
(3R,4R)-4-(((7-(benzylamino)-3-isopropylpyrazolo[1,5-a]pyrimidin-5-yl)amino)methyl)piperidin-3-ol
3-Piperidinol, 4-[[[3-(1-methylethyl)-7-[(phenylmethyl)amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]-, (3R,4R)-
[Molecular Formula]

C22H30N6O
[MDL Number]

MFCD32638713
[MOL File]

1805833-75-3.mol
[Molecular Weight]

394.51
Chemical PropertiesBack Directory
[density ]

1.30±0.1 g/cm3(Predicted)
[pka]

14.69±0.40(Predicted)
Hazard InformationBack Directory
[Uses]

Samuraciclib can be used to treat tuberous sclerosis complex using cyclin dependent kinase 7 (CDK7) inhibitors.
[in vivo]

Samuraciclib (ICEC0942; 100 mg/kg; oral gavage; daily; for 14 days; female nu/nu-BALB/c athymic nude mice) treatment inhibits tumor growth by 60% at day 14, and is accompanied by highly significant reductions in PolII Ser2 and Ser5 phosphorylation in PBMCs and in tumors[1].
The combination of Samuraciclib (ICEC0942) and ICI 47699 treatment shows complete growth arrest of estrogen receptor (ER)-positive tumor xenografts[1].

Animal Model:Female nu/nu-BALB/c athymic nude mice (7-week old) with MCF7 cells[1].
Dosage:100 mg/kg
Administration:Oral gavage; daily; for 14 days
Result:At day 14, tumor growth was inhibited by 60%.
[IC 50]

CDK7/CycH/MAT1: 41 nM (IC50); CDK2/cycE1: 578 nM (IC50); CDK1: 1.8 μM (IC50); CDK4: 49 μM (IC50); CDK5: 9.4 μM (IC50); CDK6: 34 μM (IC50); CDK9: 1.2 μM (IC50)
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