AC1NAXS6 structure

AC1NAXS6

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

CAS: 844648-32-4
Molecular Formula C32H28N6O3
Molecular Weight 544.2223 g/mol
LogP 6.10876
Topological Polar Surface Area 88.59 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 544.2223
Monoisotopic Mass 544.2223
Heavy Atoms 41
Complexity 1893.3169

Chemical Identifiers

CAS Number 844648-32-4
SMILES CC1=C(C(=CC=C1)OCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)N(N=C5C)C6=CC=CC=C6)C7=CC=C(C=C7)OC)C

Product Overview

AC1NAXS6 (CAS 844648-32-4), with molecular formula C32H28N6O3 and molecular weight 544.2223 g/mol. IUPAC: 4-[(2,3-dimethylphenoxy)methyl]-16-(4-methoxyphenyl)-14-methyl-12-phenyl-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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