2-benzyl-8-[(4-fluorophenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-benzyl-8-[(4-fluorophenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-benzyl-8-[(4-fluorophenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-1064 |
| Compound Name: | 2-benzyl-8-[(4-fluorophenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 445.51 |
| Molecular Formula: | C22 H24 F N3 O4 S |
| Smiles: | C1CN(CCN2C1C(N(CC2=O)Cc1ccccc1)=O)S(Cc1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.272 |
| logD: | 1.272 |
| logSw: | -2.178 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.047 |
| InChI Key: | CDXJXWBWURJQOE-HXUWFJFHSA-N |