5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pentanamide
Chemical Structure Depiction of
5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pentanamide
5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pentanamide
Compound characteristics
| Compound ID: | Y043-1756 |
| Compound Name: | 5-[rel-(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pentanamide |
| Molecular Weight: | 409.5 |
| Molecular Formula: | C19 H27 N3 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CCCC[C@H]1[C@@H]2[C@H](CS1)NC(N2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.4333 |
| logD: | 1.4326 |
| logSw: | -2.1868 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.757 |
| InChI Key: | IEIFSSZMBSDEJK-MJEQTWJJSA-N |