2-(4-butoxyphenyl)-5-(3,4-dimethoxyphenyl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-5-(3,4-dimethoxyphenyl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
2-(4-butoxyphenyl)-5-(3,4-dimethoxyphenyl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Compound characteristics
| Compound ID: | 8001-5416 |
| Compound Name: | 2-(4-butoxyphenyl)-5-(3,4-dimethoxyphenyl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one |
| Molecular Weight: | 533.67 |
| Molecular Formula: | C35 H35 N O4 |
| Smiles: | CCCCOc1ccc(cc1)C1CC2=C(C(c3ccc(c(c3)OC)OC)Nc3ccc4ccccc4c23)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.8933 |
| logD: | 7.8933 |
| logSw: | -6.9845 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.339 |
| InChI Key: | KWRXYIZHROWWHE-UHFFFAOYSA-N |