Vitas-M small molecule compound

2-{2-[(4-bromophenyl)carbonyl]-1-(4-chlorophenyl)butyl}-N,N'-dicyclohexylpropanediamide

Catalog ID
STK684421
SMILES CCC(C(=O)c1ccc(cc1)Br)C(C(C(=O)NC1CCCCC1)C(=O)NC1CCCCC1)c1ccc(cc1)Cl

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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 C32H40BrClN2O3 MW 616.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40BrClN2O3/c1-2-27(30(37)22-13-17-23(33)18-14-22)28(21-15-19-24(34)20-16-21)29(31(38)35-25-9-5-3-6-10-25)32(39)36-26-11-7-4-8-12-26/h13-20,25-29H,2-12H2,1H3,(H,35,38)(H,36,39)
InChIKey
BKJDWVREVBKTTB-UHFFFAOYSA-N
Synonyms
2(2((4BROMOPHENYL)CARBONYL)1(4CHLOROPHENYL)BUTYL)NNDICYCLOHEXYLPROPANEDIAMIDE
2(2(4BROMOBENZOYL)1(4CHLOROPHENYL)BUTYL)NNDICYCLOHEXYLPROPANEDIAMIDE
CCC(C(C1=CC=C(C=C1)Cl)C(C(=O)NC2CCCCC2)C(=O)NC3CCCCC3)C(=O)C4=CC=C(C=C4)Br
Registry IDs
MFCD05854433
ZINC000098007050
ZINC000098007053

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Available files

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