5-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-3,3-dimethyl-3,4,5,6-tetrahydrobenzo[a]phenanthridin-1(2H)-one
Chemical Structure Depiction of
5-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-3,3-dimethyl-3,4,5,6-tetrahydrobenzo[a]phenanthridin-1(2H)-one
5-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-3,3-dimethyl-3,4,5,6-tetrahydrobenzo[a]phenanthridin-1(2H)-one
Compound characteristics
| Compound ID: | 8006-4034 |
| Compound Name: | 5-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-3,3-dimethyl-3,4,5,6-tetrahydrobenzo[a]phenanthridin-1(2H)-one |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C30 H26 N2 O5 |
| Smiles: | CC1(C)CC2C(c3ccc(c4ccc(cc4OC)[N+]([O-])=O)o3)Nc3ccc4ccccc4c3C=2C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7284 |
| logD: | 6.7284 |
| logSw: | -6.7253 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.343 |
| InChI Key: | COYNNYVAFQBWHN-GDLZYMKVSA-N |