HIT ID: HIT212655887
Cas No: 283159-90-0
分子式: C19H27ClN2O5
分子量: 398.88
常用名: Valifenalate
氢键受体数 (HBA): 3
氢键供体数 (HBD): 2
LogP: 3.186213
IUPAC: methyl 3-(4-chlorophenyl)-3-(3-methyl-2-{[(propan-2-yloxy)carbonyl]amino}butanamido)propanoate
IUPAC: methyl 3-(4-chlorophenyl)-3-(3-methyl-2-{[(propan-2-yloxy)carbonyl]amino}butanamido)propanoate
SMILES: COC(=O)CC(NC(=O)C(NC(=O)OC(C)C)C(C)C)c1ccc(Cl)cc1
SMILES: COC(=O)CC(NC(=O)C(NC(=O)OC(C)C)C(C)C)c1ccc(Cl)cc1
InChI key: DBXFMOWZRXXBRN-UHFFFAOYSA-N