Vitas-M small molecule compound
3-{carboxy[4-(pyridin-3-ylmethyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-6-carboxylic acid
Catalog ID
STK940504
SMILES OC(=O)C(c1cn(c2c1ccc(c2)C(=O)O)C)N1CCN(CC1)Cc1cccnc1
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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 C22H24N4O4 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O4/c1-24-14-18(17-5-4-16(21(27)28)11-19(17)24)20(22(29)30)26-9-7-25(8-10-26)13-15-3-2-6-23-12-15/h2-6,11-12,14,20H,7-10,13H2,1H3,(H,27,28)(H,29,30)InChIKey
PEOIBYQKPLKOLN-UHFFFAOYSA-NSynonyms
1214227-13-01214227130
3(carboxy(4(pyridin3ylmethyl)piperazin1yl)methyl)1methyl1Hindole6carboxylicacid
3(carboxy(4(pyridin3ylmethyl)piperazin1yl)methyl)1methylindole6carboxylicacid
CN1C=C(C2=C1C=C(C=C2)C(=O)O)C(C(=O)O)N3CCN(CC3)CC4=CN=CC=C4
InChI=1SC22H24N4O4c1241418(175416(21(27)28)1119(17)24)20(22(29)30)269725(81026)1315326231215h2611121420H71013H21H3(H2728)(H2930)
MFCD13760283
ZINC000036365233
ZINC000036365235
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