N-[(3S,7S,8aS)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-0172 |
| Compound Name: | N-[(3S,7S,8aS)-2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C21 H33 N5 O3 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1C(CCn1c(C)cc(C)n1)=O)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.2009 |
| logD: | 0.2006 |
| logSw: | -1.2457 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.576 |
| InChI Key: | RSQJBFWUZKZJQX-QYZOEREBSA-N |