Vitas-M small molecule compound

2-(azepan-1-yl)-6-phenylpyrimidine-4-carbonitrile

Catalog ID
STK535795
SMILES N#Cc1nc(nc(c1)c1ccccc1)N1CCCCCC1

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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 C17H18N4 MW 278.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4/c18-13-15-12-16(14-8-4-3-5-9-14)20-17(19-15)21-10-6-1-2-7-11-21/h3-5,8-9,12H,1-2,6-7,10-11H2
InChIKey
ZNRZCXBBPHLSMR-UHFFFAOYSA-N
Synonyms

2(azepan1yl)6phenylpyrimidine4carbonitrile
C1CCCN(CC1)C2=NC(=CC(=N2)C3=CC=CC=C3)C#N
InChI=1SC17H18N4c1813151216(148435914)2017(1915)211061271121h358912H12671011H2
MFCD02955957
ZINC000000076028
ZINC00076028
ZINC76028

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Available files

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