AC1NKB5Z structure

AC1NKB5Z

12-(4-chlorophenyl)-14-methyl-16-phenyl-4-pyridin-4-yl-10-oxa-3,5,6,8,12,13-hexazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2,4,7,11(15),13-hexaene

Also Known As: 8-(4-chlorophenyl)-10-methyl-11-phenyl-2-(pyridin-4-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

CAS: 902016-95-9
Molecular Formula C27H18ClN7O
Molecular Weight 491.12613 g/mol
LogP 5.61972
Topological Polar Surface Area 83.02 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 491.12613
Monoisotopic Mass 491.12613
Heavy Atoms 36
Complexity 1727.9432

Chemical Identifiers

CAS Number 902016-95-9
SMILES CC1=NN(C2=C1C(C3=C(O2)N=CN4C3=NC(=N4)C5=CC=NC=C5)C6=CC=CC=C6)C7=CC=C(C=C7)Cl

Product Overview

AC1NKB5Z (CAS 902016-95-9), with molecular formula C27H18ClN7O and molecular weight 491.12613 g/mol. IUPAC: 12-(4-chlorophenyl)-14-methyl-16-phenyl-4-pyridin-4-yl-10-oxa-3,5,6,8,12,13-hexazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2,4,7,11(15),13-hexaene.

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