N-[(3S,7S,8aS)-2-(benzenesulfonyl)-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-(benzenesulfonyl)-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-2-(benzenesulfonyl)-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-0001 |
| Compound Name: | N-[(3S,7S,8aS)-2-(benzenesulfonyl)-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 351.42 |
| Molecular Formula: | C16 H21 N3 O4 S |
| Smiles: | CC(N[C@H]1C[C@H]2CN([C@@H](C)C(N2C1)=O)S(c1ccccc1)(=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.1513 |
| logD: | 0.1513 |
| logSw: | -2.2405 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.596 |
| InChI Key: | OSBHBNIJSMKQPE-IACUBPJLSA-N |