HIT ID: HIT218849628
Cas No: 2702965-64-6
分子式: C29H37ClFN9O2
分子量: 598.12
常用名: DBPR728
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 1-{5-[(2-{[1-(3-chloro-2-fluorobenzoyl)piperidin-4-yl]amino}-6-(4-ethylpiperazin-1-yl)pyrimidin-4-yl)amino]-3-methyl-1H-pyrazol-1-yl}propan-1-one
IUPAC: 1-{5-[(2-{[1-(3-chloro-2-fluorobenzoyl)piperidin-4-yl]amino}-6-(4-ethylpiperazin-1-yl)pyrimidin-4-yl)amino]-3-methyl-1H-pyrazol-1-yl}propan-1-one
SMILES: CCN1CCN(CC1)c1cc(Nc2cc(C)nn2C(=O)CC)nc(NC2CCN(CC2)C(=O)c2cccc(Cl)c2F)n1
SMILES: CCN1CCN(CC1)c1cc(Nc2cc(C)nn2C(=O)CC)nc(NC2CCN(CC2)C(=O)c2cccc(Cl)c2F)n1
InChI key: ZDLRMSAQXDMQSS-UHFFFAOYSA-N
