Vitas-M small molecule compound

[4-(ethoxycarbonyl)piperazin-1-yl]{6-[(phenylcarbonyl)amino]-1H-indol-3-yl}acetic acid

Catalog ID
STK656540
SMILES CCOC(=O)N1CCN(CC1)C(c1c[nH]c2c1ccc(c2)NC(=O)c1ccccc1)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 C24H26N4O5 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O5/c1-2-33-24(32)28-12-10-27(11-13-28)21(23(30)31)19-15-25-20-14-17(8-9-18(19)20)26-22(29)16-6-4-3-5-7-16/h3-9,14-15,21,25H,2,10-13H2,1H3,(H,26,29)(H,30,31)
InChIKey
PDVOATWGSMTQND-UHFFFAOYSA-N
Synonyms
1144484-02-5
(4(ethoxycarbonyl)piperazin1yl)(6((phenylcarbonyl)amino)1Hindol3yl)aceticacid
1144484025
2(6benzamido1Hindol3yl)2(4(ethoxycarbonyl)piperazin1yl)aceticacid
2(6benzamido1Hindol3yl)2(4ethoxycarbonylpiperazin1yl)aceticacid
CCOC(=O)N1CCN(CC1)C(c1c(nH)c2c1ccc(c2)NC(=O)c1ccccc1)C(=O)O
CCOC(=O)N1CCN(CC1)C(C2=CNC3=C2C=CC(=C3)NC(=O)C4=CC=CC=C4)C(=O)O
InChI=1SC24H26N4O5c123324(32)28121027(111328)21(23(30)31)191525201417(8918(19)20)2622(29)166435716h3914152125H21013H21H3(H2629)(H3031)
MFCD12217340
ZINC000032103223
ZINC000032103224

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.