4-(9,9-dimethyl-11-oxo-7,7a,8,9,10,11-hexahydrobenzo[b][4,7]phenanthrolin-12-yl)-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-(9,9-dimethyl-11-oxo-7,7a,8,9,10,11-hexahydrobenzo[b][4,7]phenanthrolin-12-yl)-2-methoxyphenyl acetate
4-(9,9-dimethyl-11-oxo-7,7a,8,9,10,11-hexahydrobenzo[b][4,7]phenanthrolin-12-yl)-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 8013-2914 |
| Compound Name: | 4-(9,9-dimethyl-11-oxo-7,7a,8,9,10,11-hexahydrobenzo[b][4,7]phenanthrolin-12-yl)-2-methoxyphenyl acetate |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C27 H26 N2 O4 |
| Smiles: | CC(=O)Oc1ccc(cc1OC)C1=C2C(CC(C)(C)CC2=O)Nc2ccc3c(cccn3)c12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1364 |
| logD: | 4.1363 |
| logSw: | -4.6197 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.332 |
| InChI Key: | ZYXMJPUTWGUMEF-FQEVSTJZSA-N |