AC1NKE9M structure

AC1NKE9M

4-[(4-methoxyphenyl)methyl]-14-methyl-12-phenyl-16-pyridin-3-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: 2-(4-methoxybenzyl)-10-methyl-8-phenyl-11-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

CAS: 902016-09-5
Molecular Formula C29H23N7O2
Molecular Weight 501.1913 g/mol
LogP 4.89872
Topological Polar Surface Area 92.25 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 501.1913
Monoisotopic Mass 501.1913
Heavy Atoms 38
Complexity 1760.6686

Chemical Identifiers

CAS Number 902016-09-5
SMILES CC1=NN(C2=C1C(C3=C(O2)N=CN4C3=NC(=N4)CC5=CC=C(C=C5)OC)C6=CN=CC=C6)C7=CC=CC=C7

Product Overview

AC1NKE9M (CAS 902016-09-5), with molecular formula C29H23N7O2 and molecular weight 501.1913 g/mol. IUPAC: 4-[(4-methoxyphenyl)methyl]-14-methyl-12-phenyl-16-pyridin-3-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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