2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl adamantane-1-carboxylate
Chemical Structure Depiction of
2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl adamantane-1-carboxylate
2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl adamantane-1-carboxylate
Compound characteristics
| Compound ID: | 8014-7716 |
| Compound Name: | 2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl adamantane-1-carboxylate |
| Molecular Weight: | 533.67 |
| Molecular Formula: | C35 H35 N O4 |
| Smiles: | COc1cc(ccc1OC(C12CC3CC(CC(C3)C2)C1)=O)C1C2=C(CCCC2=O)c2c(ccc3ccccc23)N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.938 |
| logD: | 7.938 |
| logSw: | -7.0873 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.06 |
| InChI Key: | ZJIMVAOLVURSQP-BNEHMXCCSA-N |