Vitas-M small molecule compound

3-(azepan-1-yl)-N-(4-bromo-3-methylphenyl)propanamide

Catalog ID
STK145990
SMILES O=C(Nc1ccc(c(c1)C)Br)CCN1CCCCCC1

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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 C16H23BrN2O MW 339.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23BrN2O/c1-13-12-14(6-7-15(13)17)18-16(20)8-11-19-9-4-2-3-5-10-19/h6-7,12H,2-5,8-11H2,1H3,(H,18,20)
InChIKey
XVQRNGIMMISOSA-UHFFFAOYSA-N
Synonyms
428834-22-4
3(1AZEPANYL)N(4BROMO3METHYLPHENYL)PROPANAMIDE
3(AZEPAN1YL)N(4BROMO3METHYLPHENYL)PROPANAMIDE
3AZEPAN1YLN(4BROMO3METHYLPHENYL)PROPIONAMIDE
428834224
CC1=C(C=CC(=C1)NC(=O)CCN2CCCCCC2)Br
InChI=1SC16H23BrN2Oc1131214(6715(13)17)1816(20)81119942351019h6712H25811H21H3(H1820)
MFCD02815503
ZINC000000176182
ZINC176182

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Available files

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