2-benzyl-8-[(4-methylphenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-benzyl-8-[(4-methylphenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-benzyl-8-[(4-methylphenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-1063 |
| Compound Name: | 2-benzyl-8-[(4-methylphenyl)methanesulfonyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | Cc1ccc(CS(N2CCC3C(N(CC(N3CC2)=O)Cc2ccccc2)=O)(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6663 |
| logD: | 1.6663 |
| logSw: | -2.2462 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.047 |
| InChI Key: | GPOZCNLADPCCAH-OAQYLSRUSA-N |