ethyl [5-bromo-4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate
Chemical Structure Depiction of
ethyl [5-bromo-4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate
ethyl [5-bromo-4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate
Compound characteristics
| Compound ID: | 8008-2055 |
| Compound Name: | ethyl [5-bromo-4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate |
| Molecular Weight: | 564.48 |
| Molecular Formula: | C30 H30 Br N O5 |
| Smiles: | CCOC(COc1cc(c(cc1OC)C1C2=C(CC(C)(C)CC2=O)c2c(ccc3ccccc23)N1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3128 |
| logD: | 5.3128 |
| logSw: | -6.5355 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.307 |
| InChI Key: | NKTKSWJTMQXXHW-LJAQVGFWSA-N |