HIT ID: HIT212005461
Cas No: 912806-16-7
分子式: C22H27ClN6O2
分子量: 442.95
常用名: BMS-582949 hydrochloride
氢键受体数 (HBA): 5
氢键供体数 (HBD): 3
LogP: 3.3520987
IUPAC: 4-{[5-(cyclopropylcarbamoyl)-2-methylphenyl]amino}-5-methyl-N-propylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide hydrochloride
IUPAC: 4-{[5-(cyclopropylcarbamoyl)-2-methylphenyl]amino}-5-methyl-N-propylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide hydrochloride
SMILES: Cl.CCCNC(=O)c1cn2ncnc(Nc3cc(ccc3C)C(=O)NC3CC3)c2c1C
SMILES: Cl.CCCNC(=O)c1cn2ncnc(Nc3cc(ccc3C)C(=O)NC3CC3)c2c1C
InChI key: BIYQUPNVBIOJIY-UHFFFAOYSA-N
