Vitas-M small molecule compound

1-ethyl-6-fluoro-4-oxo-7-{4-[(3,4,5-trimethoxyphenyl)carbonyl]piperazin-1-yl}-1,4-dihydroquinoline-3-carboxylic acid

Catalog ID
STK540015
SMILES COc1cc(cc(c1OC)OC)C(=O)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

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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 C26H28FN3O7 MW 513.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28FN3O7/c1-5-28-14-17(26(33)34)23(31)16-12-18(27)20(13-19(16)28)29-6-8-30(9-7-29)25(32)15-10-21(35-2)24(37-4)22(11-15)36-3/h10-14H,5-9H2,1-4H3,(H,33,34)
InChIKey
LWSQAOYBZGCGMJ-UHFFFAOYSA-N
Synonyms
135038-35-6
135038356
1ethyl6fluoro4oxo7(4((345trimethoxyphenyl)carbonyl)piperazin1yl)14dihydroquinoline3carboxylicacid
1ethyl6fluoro4oxo7(4(345trimethoxybenzoyl)piperazin1yl)14dihydroquinoline3carboxylicacid
1ETHYL6FLUORO4OXO7(4(345TRIMETHOXYBENZOYL)PIPERAZIN1YL)QUINOLINE3CARBOXYLICACID
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=CC(=C(C(=C4)OC)OC)OC)F)C(=O)O
InChI=1SC26H28FN3O7c15281417(26(33)34)23(31)161218(27)20(1319(16)28)296830(9729)25(32)151021(352)24(374)22(1115)363h1014H59H214H3(H3334)
MFCD03285112
ZINC000001250934
ZINC1250934

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Available files

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