N-[(3S,7S,8aS)-3-methyl-4-oxo-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-3-methyl-4-oxo-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-3-methyl-4-oxo-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-1167 |
| Compound Name: | N-[(3S,7S,8aS)-3-methyl-4-oxo-2-{[1-(propan-2-yl)-1H-pyrazol-4-yl]methyl}octahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 333.43 |
| Molecular Formula: | C17 H27 N5 O2 |
| Smiles: | CC(C)n1cc(CN2C[C@@H]3C[C@@H](CN3C([C@@H]2C)=O)NC(C)=O)cn1 |
| Stereo: | ABSOLUTE |
| logP: | -0.2385 |
| logD: | -5.0953 |
| logSw: | -0.8726 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.968 |
| InChI Key: | KVIRGAYWCJYXOE-MAZHCROVSA-N |