5-{2-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl}-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Chemical Structure Depiction of
5-{2-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl}-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
5-{2-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl}-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Compound characteristics
| Compound ID: | 8007-8270 |
| Compound Name: | 5-{2-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl}-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one |
| Molecular Weight: | 637.4 |
| Molecular Formula: | C33 H28 Br Cl2 N O3 |
| Smiles: | CC1(C)CC2=C(C(c3cc(c(cc3[Br])OCc3ccc(cc3[Cl])[Cl])OC)Nc3ccc4ccccc4c23)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.2363 |
| logD: | 8.2363 |
| logSw: | -6.9504 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.876 |
| InChI Key: | IWNGAEUFKHVUFV-YTTGMZPUSA-N |