Vitas-M small molecule compound
3-{carboxy[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-6-carboxylic acid
Catalog ID
STK934817
SMILES OC(=O)C(c1cn(c2c1ccc(c2)C(=O)O)C)N1CCN(CC1)c1cccc(c1C)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/c1-15-5-4-6-20(16(15)2)26-9-11-27(12-10-26)22(24(30)31)19-14-25(3)21-13-17(23(28)29)7-8-18(19)21/h4-8,13-14,22H,9-12H2,1-3H3,(H,28,29)(H,30,31)InChIKey
SQYJSHXOWHJEKY-UHFFFAOYSA-NSynonyms
1214098-08-41214098084
3(carboxy(4(23dimethylphenyl)piperazin1yl)methyl)1methyl1Hindole6carboxylicacid
3(carboxy(4(23dimethylphenyl)piperazin1yl)methyl)1methylindole6carboxylicacid
CC1=C(C(=CC=C1)N2CCN(CC2)C(C3=CN(C4=C3C=CC(=C4)C(=O)O)C)C(=O)O)C
InChI=1SC24H27N3O4c11554620(16(15)2)2691127(121026)22(24(30)31)191425(3)211317(23(28)29)7818(19)21h48131422H912H213H3(H2829)(H3031)
MFCD13755914
ZINC000036353687
ZINC000036353689
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