Vitas-M small molecule compound

N-[2-(dimethylamino)ethyl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide

Catalog ID
STK529751
SMILES CCn1cc(C(=O)NCCN(C)C)c(=O)c2c1cc(N1CCN(CC1)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 C21H30FN5O2 MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30FN5O2/c1-5-26-14-16(21(29)23-6-7-24(2)3)20(28)15-12-17(22)19(13-18(15)26)27-10-8-25(4)9-11-27/h12-14H,5-11H2,1-4H3,(H,23,29)
InChIKey
LFKQRBWNEGKGGZ-UHFFFAOYSA-N
Synonyms

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NCCN(C)C
CCn1cc(C(=O)NCCN(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)FClCl
InChI=1SC21H30FN5O2c15261416(21(29)236724(2)3)20(28)151217(22)19(1318(15)26)2710825(4)91127h1214H511H214H3(H2329)
MFCD01853563
N(2(dimethylamino)ethyl)1ethyl6fluoro7(4methylpiperazin1yl)4oxo14dihydroquinoline3carboxamide
N(2(dimethylamino)ethyl)1ethyl6fluoro7(4methylpiperazin1yl)4oxo14dihydroquinoline3carboxamidedihydrochloride
N(2(dimethylamino)ethyl)1ethyl6fluoro7(4methylpiperazin1yl)4oxoquinoline3carboxamide
N(2DIMETHYLAMINOETHYL)1ETHYL6FLUORO7(4METHYLPIPERAZIN1YL)4OXOQUINOLINE3CARBOXAMIDE
ZINC000001305300
ZINC1305300

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.