N-(3-chlorophenyl)-2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
N-(3-chlorophenyl)-2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | SB42-1127 |
| Compound Name: | N-(3-chlorophenyl)-2-[(5S,8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 436.94 |
| Molecular Formula: | C21 H29 Cl N4 O4 |
| Smiles: | CC(C)C[C@H]1C(N(CCOC)C[C@@H]2CN(CC(Nc3cccc(c3)[Cl])=O)C(N12)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7573 |
| logD: | 2.7572 |
| logSw: | -3.4661 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.109 |
| InChI Key: | BQFIXOXHQUCDET-ROUUACIJSA-N |