N-(3,5-dimethylphenyl)-2-[rel-(3aR,6aS)-3-(4-ethylphenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-[rel-(3aR,6aS)-3-(4-ethylphenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide
N-(3,5-dimethylphenyl)-2-[rel-(3aR,6aS)-3-(4-ethylphenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G012-0089 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-[rel-(3aR,6aS)-3-(4-ethylphenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | CCc1ccc(cc1)N1C(N(CC(Nc2cc(C)cc(C)c2)=O)[C@@H]2CS(C[C@H]12)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2439 |
| logD: | 3.2438 |
| logSw: | -3.3403 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.722 |
| InChI Key: | QLNGSRWZURGZTM-UHFFFAOYSA-N |