N-[(7S,8aS)-4-oxo-2-{[4-(trifluoromethyl)phenyl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(7S,8aS)-4-oxo-2-{[4-(trifluoromethyl)phenyl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(7S,8aS)-4-oxo-2-{[4-(trifluoromethyl)phenyl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-2013 |
| Compound Name: | N-[(7S,8aS)-4-oxo-2-{[4-(trifluoromethyl)phenyl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 355.36 |
| Molecular Formula: | C17 H20 F3 N3 O2 |
| Smiles: | CC(N[C@H]1C[C@H]2CN(CC(N2C1)=O)Cc1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.1245 |
| logD: | 0.9459 |
| logSw: | -2.1188 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.943 |
| InChI Key: | RZZNYVVZRAGLLK-HUUCEWRRSA-N |