2-[(5S,8aS)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
Chemical Structure Depiction of
2-[(5S,8aS)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
2-[(5S,8aS)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
Compound characteristics
| Compound ID: | SB41-1005 |
| Compound Name: | 2-[(5S,8aS)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide |
| Molecular Weight: | 448.57 |
| Molecular Formula: | C22 H36 N6 O4 |
| Smiles: | CC(C)C[C@H]1C(N(CCOC)C[C@H]2CN(CC(NCc3c(C)nn(C)c3C)=O)C(N12)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.3281 |
| logD: | 0.3281 |
| logSw: | -1.2556 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.27 |
| InChI Key: | QEPFTIRAHWQILD-MJGOQNOKSA-N |