N-{(7S,8aS)-2-[(2,5-dimethylphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(7S,8aS)-2-[(2,5-dimethylphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(7S,8aS)-2-[(2,5-dimethylphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-1987 |
| Compound Name: | N-{(7S,8aS)-2-[(2,5-dimethylphenyl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 315.41 |
| Molecular Formula: | C18 H25 N3 O2 |
| Smiles: | CC(N[C@H]1C[C@H]2CN(CC(N2C1)=O)Cc1cc(C)ccc1C)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4518 |
| logD: | 1.379 |
| logSw: | -2.149 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.943 |
| InChI Key: | YIMAURREGOLDMM-SJORKVTESA-N |