Vitas-M small molecule compound

N-cyclopentyl-1-{[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl](phenyl)amino}cyclohexanecarboxamide

Catalog ID
STK149169
SMILES O=C(N(C1(CCCCC1)C(=O)NC1CCCC1)c1ccccc1)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

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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 C35H50N2O3 MW 546.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H50N2O3/c1-33(2,3)28-23-25(24-29(31(28)39)34(4,5)6)19-20-30(38)37(27-17-9-7-10-18-27)35(21-13-8-14-22-35)32(40)36-26-15-11-12-16-26/h7,9-10,17-18,23-24,26,39H,8,11-16,19-22H2,1-6H3,(H,36,40)
InChIKey
PMDDBKCGQRPUFK-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N(C2=CC=CC=C2)C3(CCCCC3)C(=O)NC4CCCC4
InChI=1SC35H50N2O3c133(23)282325(2429(31(28)39)34(45)6)192030(38)37(271797101827)35(21138142235)32(40)36261511121626h7910171823242639H811161922H216H3(H3640)
MFCD03828734
NCYCLOPENTYL1((3(35DITERTBUTYL4HYDROXYPHENYL)PROPANOYL)(PHENYL)AMINO)CYCLOHEXANECARBOXAMIDE
NCYCLOPENTYL1(N(3(35DITERTBUTYL4HYDROXYPHENYL)PROPANOYL)ANILINO)CYCLOHEXANE1CARBOXAMIDE
ZINC000009720358
ZINC09720358
ZINC9720358

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Available files

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