Vitas-M small molecule compound

7-(4-acetyl-3,5-dimethylpiperazin-1-yl)-1-cyclopropyl-5,6,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Catalog ID
STK719710
SMILES CC(=O)N1C(C)CN(CC1C)c1c(F)c(F)c2c(c1F)n(cc(c2=O)C(=O)O)C1CC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H22F3N3O4 MW 437.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3N3O4/c1-9-6-25(7-10(2)27(9)11(3)28)19-16(23)15(22)14-18(17(19)24)26(12-4-5-12)8-13(20(14)29)21(30)31/h8-10,12H,4-7H2,1-3H3,(H,30,31)
InChIKey
IFYSRUMRQMXIEJ-UHFFFAOYSA-N
Synonyms
1092344-87-0
1092344870
7(4acetyl35dimethylpiperazin1yl)1cyclopropyl568trifluoro4oxo14dihydroquinoline3carboxylicacid
7(4acetyl35dimethylpiperazin1yl)1cyclopropyl568trifluoro4oxoquinoline3carboxylicacid
CC1CN(CC(N1C(=O)C)C)C2=C(C3=C(C(=C2F)F)C(=O)C(=CN3C4CC4)C(=O)O)F
InChI=1SC21H22F3N3O4c19625(710(2)27(9)11(3)28)1916(23)15(22)1418(17(19)24)26(124512)813(20(14)29)21(30)31h81012H47H213H3(H3031)
MFCD12211565
ZINC000030819407
ZINC000030819411

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Available files

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