methyl 4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)benzoate
Chemical Structure Depiction of
methyl 4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)benzoate
methyl 4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)benzoate
Compound characteristics
| Compound ID: | 3873-0070 |
| Compound Name: | methyl 4-(11,11-dimethyl-9-oxo-7,8,9,10,11,12-hexahydrobenzo[a][4,7]phenanthrolin-8-yl)benzoate |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C26 H24 N2 O3 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)C(=O)OC)Nc3ccc4c(cccn4)c23)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6425 |
| logD: | 4.6424 |
| logSw: | -4.5884 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.14 |
| InChI Key: | XXVDEYGEAXCZNN-DEOSSOPVSA-N |