N-[(3S,7S,8aS)-2-[(4-chlorophenyl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-[(4-chlorophenyl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-2-[(4-chlorophenyl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-1531 |
| Compound Name: | N-[(3S,7S,8aS)-2-[(4-chlorophenyl)methyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 377.91 |
| Molecular Formula: | C20 H28 Cl N3 O2 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1Cc1ccc(cc1)[Cl])NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.5899 |
| logD: | 2.5591 |
| logSw: | -3.4817 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.368 |
| InChI Key: | GXOXUGSWQLPSQO-QRVBRYPASA-N |