AC1NKDE6
4-[(2-methoxyphenoxy)methyl]-16-(2-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-methoxyphenoxy)methyl]-11-(2-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-methoxyphenoxy)methyl)-11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C31H26N6O4 |
|---|---|
| Molecular Weight | 546.20154 g/mol |
| LogP | 5.50052 |
| Topological Polar Surface Area | 97.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 546.20154 |
| Monoisotopic Mass | 546.20154 |
| Heavy Atoms | 41 |
| Complexity | 1881.2761 |
Chemical Identifiers
| CAS Number | 902007-90-3 |
|---|---|
| SMILES | CC1=NN(C2=C1C(C3=C(O2)N=CN4C3=NC(=N4)COC5=CC=CC=C5OC)C6=CC=CC=C6OC)C7=CC=CC=C7 |
Product Overview
AC1NKDE6 (CAS 902007-90-3), with molecular formula C31H26N6O4 and molecular weight 546.20154 g/mol. IUPAC: 4-[(2-methoxyphenoxy)methyl]-16-(2-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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