N-{(3S,7S,8aS)-2-[(3-ethoxyphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(3S,7S,8aS)-2-[(3-ethoxyphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(3S,7S,8aS)-2-[(3-ethoxyphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-1409 |
| Compound Name: | N-{(3S,7S,8aS)-2-[(3-ethoxyphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 345.44 |
| Molecular Formula: | C19 H27 N3 O3 |
| Smiles: | CCOc1cccc(CN2C[C@@H]3C[C@@H](CN3C([C@@H]2C)=O)NC(C)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 1.1073 |
| logD: | 0.118 |
| logSw: | -2.1313 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.13 |
| InChI Key: | XLEDKMBRPRIZRR-XKQJLSEDSA-N |