8-benzoyl-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-benzoyl-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-benzoyl-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0471 |
| Compound Name: | 8-benzoyl-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 395.43 |
| Molecular Formula: | C22 H22 F N3 O3 |
| Smiles: | C1CN(CCN2C1C(N(CC2=O)Cc1cccc(c1)F)=O)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3605 |
| logD: | 1.3605 |
| logSw: | -1.8716 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.09 |
| InChI Key: | KLLBQQJBBVCZSE-IBGZPJMESA-N |