(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(2-methylpyrimidine-5-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(2-methylpyrimidine-5-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(2-methylpyrimidine-5-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S974-2642 |
| Compound Name: | (3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-(2-methylpyrimidine-5-carbonyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C19 H29 N5 O2 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1C(c1cnc(C)nc1)=O)N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.638 |
| logD: | -1.0667 |
| logSw: | -0.9673 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.674 |
| InChI Key: | DKYCRGHASGIWGI-IKGGRYGDSA-N |