4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)-2-methoxyphenyl octanoate
Chemical Structure Depiction of
4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)-2-methoxyphenyl octanoate
4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)-2-methoxyphenyl octanoate
Compound characteristics
| Compound ID: | 8013-1740 |
| Compound Name: | 4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)-2-methoxyphenyl octanoate |
| Molecular Weight: | 526.68 |
| Molecular Formula: | C33 H38 N2 O4 |
| Smiles: | CCCCCCCC(=O)Oc1ccc(cc1OC)C1C2=C(CC(C)(C)CC2=O)c2c(ccc3c2cccn3)N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.191 |
| logD: | 7.1908 |
| logSw: | -5.8373 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.738 |
| InChI Key: | MACGOPXWFGMRRX-YTTGMZPUSA-N |