Vitas-M small molecule compound

ethyl 3-{[2-(4-cyclohexylpiperazin-1-yl)propanoyl]amino}-5-methoxy-1H-indole-2-carboxylate

Catalog ID
STK536171
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)C1CCCCC1)C)cc(cc2)OC

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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 C25H36N4O4 MW 456.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N4O4/c1-4-33-25(31)23-22(20-16-19(32-3)10-11-21(20)26-23)27-24(30)17(2)28-12-14-29(15-13-28)18-8-6-5-7-9-18/h10-11,16-18,26H,4-9,12-15H2,1-3H3,(H,27,30)
InChIKey
PHWOCDHEFKLYMS-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)c2c(c1NC(=O)C(N1CCN(CC1)C1CCCCC1)C)cc(cc2)OC
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C(C)N3CCN(CC3)C4CCCCC4
ethyl3((2(4cyclohexylpiperazin1yl)propanoyl)amino)5methoxy1Hindole2carboxylate
ethyl3(2(4cyclohexylpiperazin1yl)propanamido)5methoxy1Hindole2carboxylate
ETHYL3(2(4CYCLOHEXYLPIPERAZIN1YL)PROPANOYLAMINO)5METHOXY1HINDOLE2CARBOXYLATE
InChI=1SC25H36N4O4c143325(31)2322(201619(323)101121(20)2623)2724(30)17(2)28121429(151328)188657918h1011161826H491215H213H3(H2730)
MFCD02988715
ZINC000019995295
ZINC000022939382

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Available files

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