N-{(7S,8aS)-2-[(2-ethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(7S,8aS)-2-[(2-ethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(7S,8aS)-2-[(2-ethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-2021 |
| Compound Name: | N-{(7S,8aS)-2-[(2-ethoxyphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 331.41 |
| Molecular Formula: | C18 H25 N3 O3 |
| Smiles: | CCOc1ccccc1CN1CC(N2C[C@H](C[C@H]2C1)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.7459 |
| logD: | 0.4887 |
| logSw: | -1.8578 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.154 |
| InChI Key: | CPYUHMBGMDMWSF-CVEARBPZSA-N |