8-(methanesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-(methanesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-(methanesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0478 |
| Compound Name: | 8-(methanesulfonyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 351.47 |
| Molecular Formula: | C17 H25 N3 O3 S |
| Smiles: | Cc1cccc(CN2CCN3CCN(CCC3C2=O)S(C)(=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1865 |
| logD: | 1.1865 |
| logSw: | -2.2567 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.629 |
| InChI Key: | GWAPIWUTRZKWES-MRXNPFEDSA-N |