Vitas-M small molecule compound

3-[1-(1,3-benzodioxol-5-ylmethyl)-2-hydroxy-5-oxo-4,5-dihydro-1H-imidazol-4-yl]-N-(2-methylcyclohexyl)propanamide

Catalog ID
STK653389
SMILES O=C(NC1CCCCC1C)CCC1N=C(N(C1=O)Cc1ccc2c(c1)OCO2)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 C21H27N3O5 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O5/c1-13-4-2-3-5-15(13)22-19(25)9-7-16-20(26)24(21(27)23-16)11-14-6-8-17-18(10-14)29-12-28-17/h6,8,10,13,15-16H,2-5,7,9,11-12H2,1H3,(H,22,25)(H,23,27)
InChIKey
WQEOLZRKYHJONI-UHFFFAOYSA-N
Synonyms

3(1(13benzodioxol5ylmethyl)25dioxoimidazolidin4yl)N(2methylcyclohexyl)propanamide
3(1(13benzodioxol5ylmethyl)2hydroxy5oxo45dihydro1Himidazol4yl)N(2methylcyclohexyl)propanamide
InChI=1SC21H27N3O5c113423515(13)2219(25)971620(26)24(21(27)2316)1114681718(1014)29122817h6810131516H25791112H21H3(H2225)(H2327)
MFCD18166679
ZINC000009531187
ZINC000036589801

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Available files

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