N-[(7S,8aS)-2-(2-methylbenzene-1-sulfonyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(7S,8aS)-2-(2-methylbenzene-1-sulfonyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(7S,8aS)-2-(2-methylbenzene-1-sulfonyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-2131 |
| Compound Name: | N-[(7S,8aS)-2-(2-methylbenzene-1-sulfonyl)-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(CC(N2C1)=O)S(c1ccccc1C)(=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.1308 |
| logD: | 0.1308 |
| logSw: | -2.2266 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.922 |
| InChI Key: | ZLLZMUGIXVGTSS-ZIAGYGMSSA-N |