(3S,7S,8aS)-7-(dimethylamino)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-3-(2-methylpropyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Chemical Structure Depiction of
(3S,7S,8aS)-7-(dimethylamino)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-3-(2-methylpropyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
(3S,7S,8aS)-7-(dimethylamino)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-3-(2-methylpropyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one
Compound characteristics
| Compound ID: | S974-0566 |
| Compound Name: | (3S,7S,8aS)-7-(dimethylamino)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-3-(2-methylpropyl)hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one |
| Molecular Weight: | 375.51 |
| Molecular Formula: | C20 H33 N5 O2 |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1C(Cn1c(C)cc(C)n1)=O)N(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.5514 |
| logD: | -1.1533 |
| logSw: | -0.8143 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.926 |
| InChI Key: | KOEUGUZQTDSPEJ-SQNIBIBYSA-N |