N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | SB42-0115 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5S,8aR)-5,7-dimethyl-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C20 H28 N4 O5 |
| Smiles: | C[C@H]1C(N(C)C[C@@H]2CN(CC(NCCc3ccc(c(c3)OC)OC)=O)C(N12)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.559 |
| logD: | -0.559 |
| logSw: | -2.0199 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.566 |
| InChI Key: | CFQBSWXBYDXGHU-ZFWWWQNUSA-N |