2-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl benzoate
Chemical Structure Depiction of
2-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl benzoate
2-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl benzoate
Compound characteristics
| Compound ID: | 8007-8051 |
| Compound Name: | 2-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl benzoate |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C32 H27 N O3 |
| Smiles: | CC1(C)CC2=C(C(c3ccccc3OC(c3ccccc3)=O)Nc3ccc4ccccc4c23)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5819 |
| logD: | 6.5819 |
| logSw: | -6.9767 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.396 |
| InChI Key: | HBLGETGERIVNPQ-PMERELPUSA-N |