HIT ID: HIT212025008
Cas No: 13412-64-1
分子式: C19H18Cl2N3NaO6S
分子量: 510.32
常用名: Dicloxacillin Sodium hydrate
氢键受体数 (HBA): 6
氢键供体数 (HBD): 3
LogP: 2.9057844
IUPAC: sodium 6-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-amido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrate
IUPAC: sodium 6-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-amido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrate
SMILES: O.[Na+].Cc1onc(c1C(=O)NC1C2SC(C)(C)C(N2C1=O)C([O-])=O)-c1c(Cl)cccc1Cl
SMILES: O.[Na+].Cc1onc(c1C(=O)NC1C2SC(C)(C)C(N2C1=O)C([O-])=O)-c1c(Cl)cccc1Cl
InChI key: SIGZQNJITOWQEF-UHFFFAOYSA-M
