Vitas-M small molecule compound
3-{carboxy[4-(3-chlorobenzyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-5-carboxylic acid
Catalog ID
STK648496
SMILES OC(=O)C(c1cn(c2c1cc(cc2)C(=O)O)C)N1CCN(CC1)Cc1cccc(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 C23H24ClN3O4 MW 441.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN3O4/c1-25-14-19(18-12-16(22(28)29)5-6-20(18)25)21(23(30)31)27-9-7-26(8-10-27)13-15-3-2-4-17(24)11-15/h2-6,11-12,14,21H,7-10,13H2,1H3,(H,28,29)(H,30,31)InChIKey
HNSLJYDXBOHBBP-UHFFFAOYSA-NSynonyms
1214138-60-91214138609
3(carboxy(4((3chlorophenyl)methyl)piperazin1yl)methyl)1methylindole5carboxylicacid
3(carboxy(4(3chlorobenzyl)piperazin1yl)methyl)1methyl1Hindole5carboxylicacid
CN1C=C(C2=C1C=CC(=C2)C(=O)O)C(C(=O)O)N3CCN(CC3)CC4=CC(=CC=C4)Cl
InChI=1SC23H24ClN3O4c1251419(181216(22(28)29)5620(18)25)21(23(30)31)279726(81027)131532417(24)1115h2611121421H71013H21H3(H2829)(H3031)
MFCD13758202
ZINC000036358762
ZINC000036358763
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