(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-[(3-methyl-1H-pyrazol-1-yl)acetyl]hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-[(3-methyl-1H-pyrazol-1-yl)acetyl]hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-[(3-methyl-1H-pyrazol-1-yl)acetyl]hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S974-0595 |
| Compound Name: | (3S,7S,8aS)-7-(dimethylamino)-3-(2-methylpropyl)-2-[(3-methyl-1H-pyrazol-1-yl)acetyl]hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 361.49 |
| Molecular Formula: | C19 H31 N5 O2 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1C(Cn1ccc(C)n1)=O)N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4781 |
| logD: | -1.2266 |
| logSw: | -1.4257 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.386 |
| InChI Key: | ICXAINSSBAQWMI-IKGGRYGDSA-N |