Vitas-M small molecule compound
3-(carboxy{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}methyl)-1-methyl-1H-indole-6-carboxylic acid
Catalog ID
STK932496
SMILES OC(=O)c1ccc2c(c1)n(C)cc2C(N1CCN(CC1)c1ccc(cn1)C(F)(F)F)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 C22H21F3N4O4 MW 462.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N4O4/c1-27-12-16(15-4-2-13(20(30)31)10-17(15)27)19(21(32)33)29-8-6-28(7-9-29)18-5-3-14(11-26-18)22(23,24)25/h2-5,10-12,19H,6-9H2,1H3,(H,30,31)(H,32,33)InChIKey
FNTUDBCVHRXVNF-UHFFFAOYSA-NSynonyms
1214039-01-61214039016
3(carboxy(4(5(trifluoromethyl)pyridin2yl)piperazin1yl)methyl)1methyl1Hindole6carboxylicacid
3(carboxy(4(5(trifluoromethyl)pyridin2yl)piperazin1yl)methyl)1methylindole6carboxylicacid
CN1C=C(C2=C1C=C(C=C2)C(=O)O)C(C(=O)O)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F
InChI=1SC22H21F3N4O4c1271216(154213(20(30)31)1017(15)27)19(21(32)33)298628(7929)185314(112618)22(2324)25h25101219H69H21H3(H3031)(H3233)
MFCD13757588
ZINC000036358011
ZINC000036358012
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