N-[(3S,7S,8aS)-2-(1-ethyl-1H-pyrazole-5-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-(1-ethyl-1H-pyrazole-5-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-2-(1-ethyl-1H-pyrazole-5-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-0187 |
| Compound Name: | N-[(3S,7S,8aS)-2-(1-ethyl-1H-pyrazole-5-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C19 H29 N5 O3 |
| Smiles: | CCn1c(ccn1)C(N1C[C@@H]2C[C@@H](CN2C([C@@H]1CC(C)C)=O)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4107 |
| logD: | 0.4107 |
| logSw: | -1.733 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.207 |
| InChI Key: | METLQVVGPIEMSL-VYDXJSESSA-N |