9-(3,5-dimethylbenzoyl)-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
9-(3,5-dimethylbenzoyl)-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
9-(3,5-dimethylbenzoyl)-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | SD67-0590 |
| Compound Name: | 9-(3,5-dimethylbenzoyl)-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C24 H26 F N3 O3 |
| Smiles: | Cc1cc(C)cc(c1)C(N1CCCN2C(C1)C(N(CC2=O)Cc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0768 |
| logD: | 2.0768 |
| logSw: | -2.5495 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.024 |
| InChI Key: | BRQGOGPEHYNJMC-NRFANRHFSA-N |