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Chemical structure of MK-8776(SCH-900776)

GC16374

MK-8776(SCH-900776)

Also known as 6-bromo-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine

MK-8776(SCH-900776) (MK-8776) is a potent, selective and orally bioavailable inhibitor of checkpoint kinase1 (Chk1) with an IC50 of 3 nM· MK-8776(SCH-900776) shows 50- and 500-fold selectivity over CDK2 and Chk2, respectively

ChemicalCAS891494-63-6MW376.25FormulaC15H18BrN7
CAS number
891494-63-6
Molecular weight
376.25
Formula
C15H18BrN7
Solubility
≥ 18·8mg/mL in DMSO
InChIKey
GMIZZEXBPRLVIV-UHFFFAOYSA-N
Catalogue number
GC16374
Brand
GLPBIO
Computed properties PubChem CID 16224745 · XLogP 0.8 · TPSA 86.1 Ų · H-bond donors 2
XLogP
0.8
TPSA
86.1 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
23

SMILES CN1C=C(C=N1)C2=C3N=C(C(=C(N3N=C2)N)Br)C4CCCNC4

Computed descriptors from PubChem (CID 16224745), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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