2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl propanoate
Chemical Structure Depiction of
2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl propanoate
2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl propanoate
Compound characteristics
| Compound ID: | 6031-1917 |
| Compound Name: | 2-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenyl propanoate |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C27 H25 N O4 |
| Smiles: | CCC(=O)Oc1ccc(cc1OC)C1C2=C(CCCC2=O)c2c(ccc3ccccc23)N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2779 |
| logD: | 5.2779 |
| logSw: | -6.3698 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.703 |
| InChI Key: | CYZNXHPBTVKKAQ-MHZLTWQESA-N |