2-methoxy-4-(9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)phenyl 4-bromobenzoate
Chemical Structure Depiction of
2-methoxy-4-(9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)phenyl 4-bromobenzoate
2-methoxy-4-(9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 6031-0241 |
| Compound Name: | 2-methoxy-4-(9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)phenyl 4-bromobenzoate |
| Molecular Weight: | 555.43 |
| Molecular Formula: | C30 H23 Br N2 O4 |
| Smiles: | COc1cc(ccc1OC(c1ccc(cc1)[Br])=O)C1C2=C(CCCC2=O)c2c(ccc3c2cccn3)N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1756 |
| logD: | 6.1754 |
| logSw: | -5.8377 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.061 |
| InChI Key: | KMTDCBMCAVUUBU-LJAQVGFWSA-N |