Vitas-M small molecule compound

4-(azepan-1-ylmethyl)-N-(2,6-dimethylphenyl)benzamide

Catalog ID
STL140600
SMILES O=C(c1ccc(cc1)CN1CCCCCC1)Nc1c(C)cccc1C

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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 C22H28N2O MW 336.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O/c1-17-8-7-9-18(2)21(17)23-22(25)20-12-10-19(11-13-20)16-24-14-5-3-4-6-15-24/h7-13H,3-6,14-16H2,1-2H3,(H,23,25)
InChIKey
QPAVCGCBWRJJFS-UHFFFAOYSA-N
Synonyms

4(azepan1ylmethyl)N(26dimethylphenyl)benzamide
CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)CN3CCCCCC3
InChI=1SC22H28N2Oc11787918(2)21(17)2322(25)20121019(111320)16241453461524h713H361416H212H3(H2325)
MFCD13982752
ZINC000038833495
ZINC38833495

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Available files

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