Vitas-M small molecule compound
1-benzyl-3-{carboxy[4-(pyridin-3-ylmethyl)piperazin-1-yl]methyl}-1H-indole-5-carboxylic acid
Catalog ID
STK934268
SMILES OC(=O)c1ccc2c(c1)c(cn2Cc1ccccc1)C(N1CCN(CC1)Cc1cccnc1)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 C28H28N4O4 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O4/c33-27(34)22-8-9-25-23(15-22)24(19-32(25)18-20-5-2-1-3-6-20)26(28(35)36)31-13-11-30(12-14-31)17-21-7-4-10-29-16-21/h1-10,15-16,19,26H,11-14,17-18H2,(H,33,34)(H,35,36)InChIKey
IWAAEQKRRTWYLM-UHFFFAOYSA-NSynonyms
1214020-60-61214020606
1benzyl3(carboxy(4(pyridin3ylmethyl)piperazin1yl)methyl)1Hindole5carboxylicacid
1benzyl3(carboxy(4(pyridin3ylmethyl)piperazin1yl)methyl)indole5carboxylicacid
C1CN(CCN1CC2=CN=CC=C2)C(C3=CN(C4=C3C=C(C=C4)C(=O)O)CC5=CC=CC=C5)C(=O)O
InChI=1SC28H28N4O4c3327(34)22892523(1522)24(1932(25)18205213620)26(28(35)36)31131130(121431)17217410291621h11015161926H11141718H2(H3334)(H3536)
MFCD13758246
ZINC000036358814
ZINC000036358815
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