Vitas-M small molecule compound
1-benzyl-3-{carboxy[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}-1H-indole-2-carboxylic acid
Catalog ID
STK935020
SMILES OC(=O)C(c1c2ccccc2n(c1C(=O)O)Cc1ccccc1)N1CCN(CC1)c1ncccn1
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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 C26H25N5O4 MW 471.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O4/c32-24(33)22(29-13-15-30(16-14-29)26-27-11-6-12-28-26)21-19-9-4-5-10-20(19)31(23(21)25(34)35)17-18-7-2-1-3-8-18/h1-12,22H,13-17H2,(H,32,33)(H,34,35)InChIKey
CFTLRBUZNRVXNA-UHFFFAOYSA-NSynonyms
1236259-52-11236259521
1benzyl3(carboxy(4(pyrimidin2yl)piperazin1yl)methyl)1Hindole2carboxylicacid
1benzyl3(carboxy(4pyrimidin2ylpiperazin1yl)methyl)indole2carboxylicacid
C1CN(CCN1C2=NC=CC=N2)C(C3=C(N(C4=CC=CC=C43)CC5=CC=CC=C5)C(=O)O)C(=O)O
InChI=1SC26H25N5O4c3224(33)22(29131530(161429)2627116122826)21199451020(19)31(23(21)25(34)35)17187213818h11222H1317H2(H3233)(H3435)
MFCD16625467
ZINC000040284425
ZINC000040284427
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