N-{(7S,8aS)-2-[(3-methoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(7S,8aS)-2-[(3-methoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(7S,8aS)-2-[(3-methoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-1956 |
| Compound Name: | N-{(7S,8aS)-2-[(3-methoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 317.39 |
| Molecular Formula: | C17 H23 N3 O3 |
| Smiles: | CC(N[C@H]1C[C@H]2CN(CC(N2C1)=O)Cc1cccc(c1)OC)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.3071 |
| logD: | -0.4004 |
| logSw: | -1.8291 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.487 |
| InChI Key: | ORQFLDZFPZNTRF-CABCVRRESA-N |