ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)-
14-(7-oxobenzo[a]phenalen-1-yl)-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9(16),10,12-heptaen-8-one
| Molecular Formula | C31H16N2O2 |
|---|---|
| Molecular Weight | 448.5 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 52.0 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 448.1212 |
| Heavy Atoms | 35 |
| Complexity | 887.0 |
Chemical Identifiers
| CAS Number | 73791-28-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C=CC4=C3C(=CC=C4)C2=O)N5C6=CC=CC7=C6C(=N5)C8=CC=CC=C8C7=O |
| InChIKey | NQBKFULMFQMZBE-UHFFFAOYSA-N |
📖 Product Overview
ANTHRA(1,9-cd)PYRAZOL-6-ONE, 2-(7-OXO-7H-BENZ(de)ANTHRACEN-1-YL)- (CAS: 73791-28-3) is a chemical compound with molecular formula C31H16N2O2 and molecular weight 448.5 g/mol. Its IUPAC systematic name is 14-(7-oxobenzo[a]phenalen-1-yl)-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9(16),10,12-heptaen-8-one.
NQBKFULMFQMZBE-UHFFFAOYSA-N.
SMILES: C1=CC=C2C(=C1)C3=C(C=CC4=C3C(=CC=C4)C2=O)N5C6=CC=CC7=C6C(=N5)C8=CC=CC=C8C7=O.
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