N-[(7S,8aS)-2-(3-fluoro-4-methylbenzoyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(7S,8aS)-2-(3-fluoro-4-methylbenzoyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(7S,8aS)-2-(3-fluoro-4-methylbenzoyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-2075 |
| Compound Name: | N-[(7S,8aS)-2-(3-fluoro-4-methylbenzoyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 333.36 |
| Molecular Formula: | C17 H20 F N3 O3 |
| Smiles: | CC(N[C@H]1C[C@H]2CN(CC(N2C1)=O)C(c1ccc(C)c(c1)F)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.3481 |
| logD: | 0.3481 |
| logSw: | -1.9681 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.859 |
| InChI Key: | YICIHRWFHKKNHV-ZIAGYGMSSA-N |