8-(benzenesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(benzenesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(benzenesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0794 |
| Compound Name: | 8-(benzenesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | Cc1cccc(CN2CC(N3CCN(CCC3C2=O)S(c2ccccc2)(=O)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1051 |
| logD: | 2.1051 |
| logSw: | -2.7859 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.153 |
| InChI Key: | NDKHEFNQLFFWIP-HXUWFJFHSA-N |