N-{(3S,7S,8aS)-3-(2-methylpropyl)-4-oxo-2-[(thiophen-3-yl)acetyl]octahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(3S,7S,8aS)-3-(2-methylpropyl)-4-oxo-2-[(thiophen-3-yl)acetyl]octahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(3S,7S,8aS)-3-(2-methylpropyl)-4-oxo-2-[(thiophen-3-yl)acetyl]octahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-0124 |
| Compound Name: | N-{(3S,7S,8aS)-3-(2-methylpropyl)-4-oxo-2-[(thiophen-3-yl)acetyl]octahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 377.5 |
| Molecular Formula: | C19 H27 N3 O3 S |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1C(Cc1ccsc1)=O)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5116 |
| logD: | 1.5116 |
| logSw: | -2.2286 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.609 |
| InChI Key: | COSHNXQCQYYUHL-ZACQAIPSSA-N |