1-ethyl-5-methyl-3,7-bis(4-methylbenzoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one
Chemical Structure Depiction of
1-ethyl-5-methyl-3,7-bis(4-methylbenzoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one
1-ethyl-5-methyl-3,7-bis(4-methylbenzoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one
Compound characteristics
| Compound ID: | D318-0626 |
| Compound Name: | 1-ethyl-5-methyl-3,7-bis(4-methylbenzoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C26 H30 N2 O3 |
| Smiles: | CCC12CN(CC(C)(CN(C1)C(c1ccc(C)cc1)=O)C2=O)C(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9532 |
| logD: | 3.9532 |
| logSw: | -3.8771 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.144 |
| InChI Key: | YOWJGZMJTVOVLX-UHFFFAOYSA-N |