N-{(3S,7S,8aS)-2-[(3,4-dimethylphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(3S,7S,8aS)-2-[(3,4-dimethylphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(3S,7S,8aS)-2-[(3,4-dimethylphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-1180 |
| Compound Name: | N-{(3S,7S,8aS)-2-[(3,4-dimethylphenyl)methyl]-3-methyl-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 329.44 |
| Molecular Formula: | C19 H27 N3 O2 |
| Smiles: | CC(N[C@H]1C[C@H]2CN(Cc3ccc(C)c(C)c3)[C@@H](C)C(N2C1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6424 |
| logD: | 1.1337 |
| logSw: | -2.3014 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.007 |
| InChI Key: | CVEVHOFBCPZVHW-QGTPRVQTSA-N |