2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0324 |
| Compound Name: | 2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 413.42 |
| Molecular Formula: | C22 H21 F2 N3 O3 |
| Smiles: | C1CN(CCN2C1C(N(CC2=O)Cc1ccccc1)=O)C(c1cc(ccc1F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8181 |
| logD: | 1.8181 |
| logSw: | -2.6509 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.09 |
| InChI Key: | XQJVTVSTAJVODB-LJQANCHMSA-N |