(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(5-methylpyridine-3-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(5-methylpyridine-3-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(5-methylpyridine-3-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S974-0550 |
| Compound Name: | (3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(5-methylpyridine-3-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C20 H30 N4 O2 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1C(c1cc(C)cnc1)=O)N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4975 |
| logD: | -0.2072 |
| logSw: | -1.2545 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.054 |
| InChI Key: | HQYWDFNLNPVPDH-SQNIBIBYSA-N |