Culmerciclib
5-fluoro-4-(2-methyl-3-propan-2-ylindazol-5-yl)-N-(5-piperazin-1-yl-2-pyridinyl)pyrimidin-2-amine
Molecular Identity
Culmerciclib
5-fluoro-4-(2-methyl-3-propan-2-ylindazol-5-yl)-N-(5-piperazin-1-yl-2-pyridinyl)pyrimidin-2-amine
PubChem CID: 122544510
2D Structure
Properties
C24H27FN8
Molecular Formula
446.50
Molecular Weight
g/mol
446.2343
Exact Mass
Da
3.4
XLogP
Drug-like (Lipinski: < 5)
83.8
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
8
H-Bond Acceptors
632
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)C1=C2C=C(C=CC2=NN1C)C3=NC(=NC=C3F)NC4=NC=C(C=C4)N5CCNCC5Isomeric SMILES
SMILES: CC(C)C1=C2C=C(C=CC2=NN1C)C3=NC(=NC=C3F)NC4=NC=C(C=C4)N5CCNCC5Synonyms(20)
Culmerciclib2004705-28-4ZU5GL4E4WH5-fluoro-4-(2-methyl-3-propan-2-ylindazol-5-yl)-N-(5-piperazin-1-ylpyridin-2-yl)pyrimidin-2-amineRefChem:1082325Culmerciclib [INN]UNII-ZU5GL4E4WH2-Pyrimidinamine, 5-fluoro-4-(2-methyl-3-(1-methylethyl)-2H-indazol-5-yl)-N-(5-(1-piperazinyl)-2-pyridinyl)-5-Fluoro-4-(2-methyl-3-(1-methylethyl)-2H-indazol-5-yl)-N-(5-(1-piperazinyl)-2-pyridinyl)-2-pyrimidinamine5-Fluoro-4-(2-methyl-3-(propan-2-yl)-2H-indazol-5-yl)- N-(5-(piperazin-1-yl)pyridin-2-yl)pyrimidin-2-amineSaitanxin (China)2-Pyrimidinamine, 5-fluoro-4-[2-methyl-3-(1-methylethyl)-2H-indazol-5-yl]-N-[5-(1-piperazinyl)-2-pyridinyl]-5-Fluoro-4-[2-methyl-3-(1-methylethyl)-2H-indazol-5-yl]-N-[5-(1-piperazinyl)-2-pyridinyl]-2-pyrimidinamine5-fluoro-4-[2-methyl-3-(propan-2-yl)-2H-indazol-5-yl]- N-[5-(piperazin-1-yl)pyridin-2-yl]pyrimidin-2-amineCulmerciclib [WHO-DD]
Data from PubChem (NCBI)
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