N-{(7S,8aS)-2-[(3-cyanophenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(7S,8aS)-2-[(3-cyanophenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(7S,8aS)-2-[(3-cyanophenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-1923 |
| Compound Name: | N-{(7S,8aS)-2-[(3-cyanophenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 312.37 |
| Molecular Formula: | C17 H20 N4 O2 |
| Smiles: | CC(N[C@H]1C[C@H]2CN(CC(N2C1)=O)Cc1cccc(C#N)c1)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.1738 |
| logD: | -0.1772 |
| logSw: | -1.7886 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62 |
| InChI Key: | JNWFLKZQUTVNGW-CVEARBPZSA-N |