N-[(2-chlorophenyl)methyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
N-[(2-chlorophenyl)methyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | SB42-0118 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 364.83 |
| Molecular Formula: | C17 H21 Cl N4 O3 |
| Smiles: | C[C@H]1C(N(C)C[C@@H]2CN(CC(NCc3ccccc3[Cl])=O)C(N12)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.9312 |
| logD: | 0.9312 |
| logSw: | -2.3292 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.464 |
| InChI Key: | HJVFOPJJMABRCY-AAEUAGOBSA-N |