2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[(thiophen-3-yl)methyl]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-[(thiophen-3-yl)methyl]acetamide
2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[(thiophen-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | SB42-1137 |
| Compound Name: | 2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N-[(thiophen-3-yl)methyl]acetamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C20 H30 N4 O4 S |
| Smiles: | CC(C)C[C@H]1C(N(CCOC)C[C@@H]2CN(CC(NCc3ccsc3)=O)C(N12)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4084 |
| logD: | 1.4084 |
| logSw: | -2.3005 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.449 |
| InChI Key: | BHXKSVPUYNESBM-IRXDYDNUSA-N |