Vitas-M small molecule compound

7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-N-[2-(1H-imidazol-4-yl)ethyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide

Catalog ID
STK647396
SMILES CCn1cc(C(=O)NCCc2c[nH]cn2)c(=O)c2c1cc(N1CCN(CC1)C(=O)C)c(c2)F

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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 C23H27FN6O3 MW 454.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27FN6O3/c1-3-28-13-18(23(33)26-5-4-16-12-25-14-27-16)22(32)17-10-19(24)21(11-20(17)28)30-8-6-29(7-9-30)15(2)31/h10-14H,3-9H2,1-2H3,(H,25,27)(H,26,33)
InChIKey
LMRFORBRPWAMLB-UHFFFAOYSA-N
Synonyms
1010895-48-3
1010895483
7(4acetylpiperazin1yl)1ethyl6fluoroN(2(1Himidazol4yl)ethyl)4oxo14dihydroquinoline3carboxamide
7(4acetylpiperazin1yl)1ethyl6fluoroN(2(1Himidazol5yl)ethyl)4oxoquinoline3carboxamide
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NCCC4=CN=CN4
CCn1cc(C(=O)NCCc2c(nH)cn2)c(=O)c2c1cc(N1CCN(CC1)C(=O)C)c(c2)F
InChI=1SC23H27FN6O3c13281318(23(33)2654161225142716)22(32)171019(24)21(1120(17)28)308629(7930)15(2)31h1014H39H212H3(H2527)(H2633)
MFCD12203834
N(2(1Himidazol4yl)ethyl)7(4acetylpiperazin1yl)1ethyl6fluoro4oxo14dihydroquinoline3carboxamide
ZINC000012323956
ZINC12323956

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Available files

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