HIT ID: HIT212070500
Cas No: 59729-37-2
分子式: C12H13N3O3S
分子量: 279.31
常用名: Fexinidazole
氢键受体数 (HBA): 4
氢键供体数 (HBD): 0
LogP: 2.384
IUPAC: 1-methyl-2-{[4-(methylsulfanyl)phenoxy]methyl}-5-nitro-1H-imidazole
IUPAC: 1-methyl-2-{[4-(methylsulfanyl)phenoxy]methyl}-5-nitro-1H-imidazole
SMILES: CSc1ccc(OCc2ncc(n2C)[N+]([O-])=O)cc1
SMILES: CSc1ccc(OCc2ncc(n2C)[N+]([O-])=O)cc1
InChI key: MIWWSGDADVMLTG-UHFFFAOYSA-N