2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[2-(1H-pyrazol-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[2-(1H-pyrazol-1-yl)ethyl]acetamide
2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[2-(1H-pyrazol-1-yl)ethyl]acetamide
Compound characteristics
Compound ID: | SB42-1170 |
Compound Name: | 2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[2-(1H-pyrazol-1-yl)ethyl]acetamide |
Molecular Weight: | 420.51 |
Molecular Formula: | C20 H32 N6 O4 |
Smiles: | CC(C)C[C@H]1C(N(CCOC)C[C@@H]2CN(CC(NCCn3cccn3)=O)C(N12)=O)=O |
Stereo: | ABSOLUTE |
logP: | -0.3867 |
logD: | -0.3867 |
logSw: | -0.8062 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.045 |
InChI Key: | YUDCGHQFYSBBIS-IRXDYDNUSA-N |