FRAX597
HIT212034204
sdf文件结构编辑类似物检索
HIT ID: HIT212034204
Cas No: 1286739-19-2
分子式: C29H28ClN7OS
分子量: 558.1
常用名: FRAX597
氢键受体数 (HBA): 7
氢键供体数 (HBD): 1
LogP: 5.1376953
IUPAC: 6-[2-chloro-4-(1,3-thiazol-5-yl)phenyl]-8-ethyl-2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
IUPAC: 6-[2-chloro-4-(1,3-thiazol-5-yl)phenyl]-8-ethyl-2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
SMILES: CCn1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2cc(-c2ccc(cc2Cl)-c2cncs2)c1=O
SMILES: CCn1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2cc(-c2ccc(cc2Cl)-c2cncs2)c1=O
InChI key: DHUJCQOUWQMVCG-UHFFFAOYSA-N
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