Vitas-M small molecule compound
1-benzyl-3-{carboxy[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]methyl}-1H-indole-2-carboxylic acid
Catalog ID
STK930567
SMILES CC(=C)CN1CCN(CC1)C(c1c(C(=O)O)n(c2c1cccc2)Cc1ccccc1)C(=O)O
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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 C26H29N3O4 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4/c1-18(2)16-27-12-14-28(15-13-27)23(25(30)31)22-20-10-6-7-11-21(20)29(24(22)26(32)33)17-19-8-4-3-5-9-19/h3-11,23H,1,12-17H2,2H3,(H,30,31)(H,32,33)InChIKey
RDDTZOANTLGCBE-UHFFFAOYSA-NSynonyms
1214833-91-61214833916
1benzyl3(carboxy(4(2methylallyl)piperazin1yl)methyl)1Hindole2carboxylicacid
1benzyl3(carboxy(4(2methylprop2en1yl)piperazin1yl)methyl)1Hindole2carboxylicacid
1benzyl3(carboxy(4(2methylprop2enyl)piperazin1yl)methyl)indole2carboxylicacid
CC(=C)CN1CCN(CC1)C(C2=C(N(C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)O)C(=O)O
InChI=1SC26H29N3O4c118(2)1627121428(151327)23(25(30)31)222010671121(20)29(24(22)26(32)33)17198435919h31123H11217H22H3(H3031)(H3233)
MFCD13760570
ZINC000036365852
ZINC000036365853
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