AC1N87AB structure

AC1N87AB

2,6-dibenzyl-4-N,8-N-bis(1,2,4-triazol-4-yl)triazolo[4,5-f]benzotriazole-4,8-diimine

Also Known As: N,N'-(2,6-dibenzylbenzo[1,2-d:4,5-d']bis[1,2,3]triazole-4,8(2H,6H)-diylidene)bis(4H-1,2,4-triazol-4-amine)|2,6-dibenzyl-4-N,8-N-bis(1,2,4-triazol-4-yl)triazolo[4,5-f]benzotriazole-4,8-diimine|2,6-bisbenzyl-4,8-bis(1,2,4-triazol-4-ylazamethylene)-2-hydro-1,2,3-triazolo[4 ,5-f]benzotriazole|4H-1,2,4-Triazol-4-amine, N,Na(2)-[2,6-bis(phenylmethyl)benzo[1,2-d:4,5-da(2)]bistriazole-4,8(2H,6H)-diylidene]bis-

CAS: 295344-76-2
Molecular Formula C24H18N14
Molecular Weight 502.1839 g/mol
LogP 1.064
Topological Polar Surface Area 147.56 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 10
Rotatable Bonds 6
Exact Mass 502.1839
Monoisotopic Mass 502.1839
Heavy Atoms 38
Complexity 1564.4962

Chemical Identifiers

CAS Number 295344-76-2
SMILES C1=CC=C(C=C1)CN2N=C3C(=N2)C(=NN4C=NN=C4)C5=NN(N=C5C3=NN6C=NN=C6)CC7=CC=CC=C7

Product Overview

AC1N87AB (CAS 295344-76-2), with molecular formula C24H18N14 and molecular weight 502.1839 g/mol. IUPAC: 2,6-dibenzyl-4-N,8-N-bis(1,2,4-triazol-4-yl)triazolo[4,5-f]benzotriazole-4,8-diimine.

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