N-{(7S,8aS)-2-[(3,5-dimethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(7S,8aS)-2-[(3,5-dimethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(7S,8aS)-2-[(3,5-dimethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-1936 |
| Compound Name: | N-{(7S,8aS)-2-[(3,5-dimethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 347.41 |
| Molecular Formula: | C18 H25 N3 O4 |
| Smiles: | CC(N[C@H]1C[C@H]2CN(CC(N2C1)=O)Cc1cc(cc(c1)OC)OC)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.3816 |
| logD: | -1.6817 |
| logSw: | -1.5291 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.031 |
| InChI Key: | QJXURGHYOMBELQ-CABCVRRESA-N |