AC1NKY80
9-(furan-2-yl)-5,5-dimethyl-13-pyridin-3-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),11,13,16-pentaen-7-one
Also Known As: 12-(furan-2-yl)-9,9-dimethyl-2-(pyridin-3-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one|12-(furan-2-yl)-9,9-dimethyl-2-(pyridin-3-yl)-9,10-dihydro-8H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11(12H)-one
| Molecular Formula | C23H19N5O3 |
|---|---|
| Molecular Weight | 413.1488 g/mol |
| LogP | 3.9468 |
| Topological Polar Surface Area | 95.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 413.1488 |
| Monoisotopic Mass | 413.1488 |
| Heavy Atoms | 31 |
| Complexity | 1352.8933 |
Chemical Identifiers
| CAS Number | 902012-46-8 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)C5=CN=CC=C5)C6=CC=CO6)C(=O)C1)C |
Product Overview
AC1NKY80 (CAS 902012-46-8), with molecular formula C23H19N5O3 and molecular weight 413.1488 g/mol. IUPAC: 9-(furan-2-yl)-5,5-dimethyl-13-pyridin-3-yl-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),11,13,16-pentaen-7-one.
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