HIT ID: HIT106692184
Cas No: 1189710-20-0
分子式: C25H32ClN5O3
分子量: 486.01
常用名: 5-butyl-N2-(3-chloro-4-methylphenyl)-N6-cyclopentyl-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
常用名: 5-butyl-N2-(3-chloro-4-methylphenyl)-N6-cyclopentyl-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
氢键受体数 (HBA): 7
氢键供体数 (HBD): 2
LogP: 5.0236
IUPAC: 5-butyl-N2-(3-chloro-4-methylphenyl)-N6-cyclopentyl-6-methyl-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
IUPAC: 5-butyl-N2-(3-chloro-4-methylphenyl)-N6-cyclopentyl-6-methyl-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
SMILES: CCCCN1C(=O)c2cc(nn2CC1(C)C(=O)NC1CCCC1)C(=O)Nc1ccc(C)c(Cl)c1
SMILES: CCCCN1C(=O)c2cc(nn2CC1(C)C(=O)NC1CCCC1)C(=O)Nc1ccc(C)c(Cl)c1
InChI key: XGNVGVLMXGFQKR-UHFFFAOYSA-N
