Vitas-M small molecule compound
3-{carboxy[4-(2,4-dimethylphenyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-5-carboxylic acid
Catalog ID
STK937725
SMILES OC(=O)C(c1cn(c2c1cc(cc2)C(=O)O)C)N1CCN(CC1)c1ccc(cc1C)C
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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 C24H27N3O4 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O4/c1-15-4-6-20(16(2)12-15)26-8-10-27(11-9-26)22(24(30)31)19-14-25(3)21-7-5-17(23(28)29)13-18(19)21/h4-7,12-14,22H,8-11H2,1-3H3,(H,28,29)(H,30,31)InChIKey
JMWIKORZJCBYCP-UHFFFAOYSA-NSynonyms
1214795-67-11214795671
3(carboxy(4(24dimethylphenyl)piperazin1yl)methyl)1methyl1Hindole5carboxylicacid
3(carboxy(4(24dimethylphenyl)piperazin1yl)methyl)1methylindole5carboxylicacid
CC1=CC(=C(C=C1)N2CCN(CC2)C(C3=CN(C4=C3C=C(C=C4)C(=O)O)C)C(=O)O)C
InChI=1SC24H27N3O4c1154620(16(2)1215)2681027(11926)22(24(30)31)191425(3)217517(23(28)29)1318(19)21h47121422H811H213H3(H2829)(H3031)
MFCD13759990
ZINC000036360900
ZINC000036360901
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