Vitas-M small molecule compound

4-(azepan-1-yl)-6-(1H-benzimidazol-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine

Catalog ID
STK028377
SMILES C1CCCN(CC1)c1nc(nc(n1)n1cnc2c1cccc2)N(c1ccccc1)c1ccccc1

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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 C28H27N7 MW 461.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N7/c1-2-12-20-33(19-11-1)26-30-27(34-21-29-24-17-9-10-18-25(24)34)32-28(31-26)35(22-13-5-3-6-14-22)23-15-7-4-8-16-23/h3-10,13-18,21H,1-2,11-12,19-20H2
InChIKey
QENBBHPWPKAKSN-UHFFFAOYSA-N
Synonyms

(4AZEPAN1YL6BENZOIMIDAZOL1YL(135)TRIAZIN2YL)DIPHENYLAMINE
4(AZEPAN1YL)6(1H13BENZODIAZOL1YL)NNDIPHENYL135TRIAZIN2AMINE
4(AZEPAN1YL)6(1HBENZIMIDAZOL1YL)NNDIPHENYL135TRIAZIN2AMINE
4(AZEPAN1YL)6(1HBENZO(D)IMIDAZOL1YL)NNDIPHENYL135TRIAZIN2AMINE
4(AZEPAN1YL)6(BENZIMIDAZOL1YL)NNDIPHENYL135TRIAZIN2AMINE
C1CCCN(CC1)c1nc(nc(n1)n1cnc2c1cccc2)N(c1ccccc1)c1ccccc1
C1CCCN(CC1)C2=NC(=NC(=N2)N3C=NC4=CC=CC=C43)N(C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC28H27N7c12122033(19111)263027(34212924179101825(24)34)3228(3126)35(22135361422)23157481623h310131821H1211121920H2
MFCD01036158
STK028377
ZINC000002070721
ZINC02070721
ZINC2070721

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Available files

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