Name: MCB-3681
Rating: 5 (10 reviews)

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HIT ID:HIT212673217
Cas No:790704-42-6
常用名:MCB-3681
IUPAC:1-cyclopropyl-7-[4-({4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy}methyl)-4-hydroxypiperidin-1-yl]-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
IUPAC:1-cyclopropyl-7-[4-({4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy}methyl)-4-hydroxypiperidin-1-yl]-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
InChI key:YEDRNPDLVCNIAV-FQEVSTJZSA-N

分子式:C31H32F2N4O8
分子量:626.614
氢键供体数 (HBD):3
氢键受体数 (HBA):10
LogP:1.7491682
SMILES:CC(=O)NC[C@H]1CN(C(=O)O1)c1ccc(OCC2(O)CCN(CC2)c2cc3n(cc(C(O)=O)c(=O)c3cc2F)C2CC2)c(F)c1
SMILES:CC(=O)NC[C@H]1CN(C(=O)O1)c1ccc(OCC2(O)CCN(CC2)c2cc3n(cc(C(O)=O)c(=O)c3cc2F)C2CC2)c(F)c1

MCB-3681, active against gram-positive bacterium, is the antibacterial Oxaquin's active substance.

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