Vitas-M small molecule compound
3-{carboxy[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-6-carboxylic acid
Catalog ID
STK930729
SMILES OC(=O)C(c1cn(c2c1ccc(c2)C(=O)O)C)N1CCN(CC1)c1cccc(c1)Cl
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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 C22H22ClN3O4 MW 427.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O4/c1-24-13-18(17-6-5-14(21(27)28)11-19(17)24)20(22(29)30)26-9-7-25(8-10-26)16-4-2-3-15(23)12-16/h2-6,11-13,20H,7-10H2,1H3,(H,27,28)(H,29,30)InChIKey
AQQANWGKVHJTBF-UHFFFAOYSA-NSynonyms
1214636-79-91214636799
3(carboxy(4(3chlorophenyl)piperazin1yl)methyl)1methyl1Hindole6carboxylicacid
3(carboxy(4(3chlorophenyl)piperazin1yl)methyl)1methylindole6carboxylicacid
CN1C=C(C2=C1C=C(C=C2)C(=O)O)C(C(=O)O)N3CCN(CC3)C4=CC(=CC=C4)Cl
InChI=1SC22H22ClN3O4c1241318(176514(21(27)28)1119(17)24)20(22(29)30)269725(81026)1642315(23)1216h26111320H710H21H3(H2728)(H2930)
MFCD13756422
ZINC000036354735
ZINC000036354737
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