Vitas-M small molecule compound

5-(azepan-1-yl)-3-phenyl[1,2,3]triazolo[1,5-a]quinazoline

Catalog ID
STL127552
SMILES C1CCCN(CC1)c1nc2c(nnn2c2c1cccc2)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 C21H21N5 MW 343.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5/c1-2-9-15-25(14-8-1)20-17-12-6-7-13-18(17)26-21(22-20)19(23-24-26)16-10-4-3-5-11-16/h3-7,10-13H,1-2,8-9,14-15H2
InChIKey
NMVLJQMQMQPGDL-UHFFFAOYSA-N
Synonyms
902482-38-6
5(azepan1yl)3phenyl(123)triazolo(15a)quinazoline
5(azepan1yl)3phenyltriazolo(15a)quinazoline
902482386
C1CCCN(CC1)C2=NC3=C(N=NN3C4=CC=CC=C42)C5=CC=CC=C5
InChI=1SC21H21N5c1291525(1481)201712671318(17)2621(2220)19(232426)16104351116h371013H12891415H2
MFCD08540965
ZINC000005035196
ZINC05035196
ZINC5035196

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Available files

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