2-benzyl-9-(3,4-difluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-benzyl-9-(3,4-difluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
2-benzyl-9-(3,4-difluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | SD67-0478 |
| Compound Name: | 2-benzyl-9-(3,4-difluorobenzoyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione |
| Molecular Weight: | 413.42 |
| Molecular Formula: | C22 H21 F2 N3 O3 |
| Smiles: | C1CN(CC2C(N(CC(N2C1)=O)Cc1ccccc1)=O)C(c1ccc(c(c1)F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5556 |
| logD: | 1.5556 |
| logSw: | -1.8606 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.024 |
| InChI Key: | HKXZKRXKESSDMW-IBGZPJMESA-N |