N-[(3S,7S,8aS)-2-(3-fluoropyridine-4-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-(3-fluoropyridine-4-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-2-(3-fluoropyridine-4-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-0108 |
| Compound Name: | N-[(3S,7S,8aS)-2-(3-fluoropyridine-4-carbonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 376.43 |
| Molecular Formula: | C19 H25 F N4 O3 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1C(c1ccncc1F)=O)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.8612 |
| logD: | 0.8612 |
| logSw: | -1.5078 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.636 |
| InChI Key: | NQBLUDOACFKMLY-CPUCHLNUSA-N |