N-(4-ethoxyphenyl)-2-[rel-(3aR,6aS)-3-(4-fluorophenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-[rel-(3aR,6aS)-3-(4-fluorophenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide
N-(4-ethoxyphenyl)-2-[rel-(3aR,6aS)-3-(4-fluorophenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G012-0374 |
| Compound Name: | N-(4-ethoxyphenyl)-2-[rel-(3aR,6aS)-3-(4-fluorophenyl)-2,5,5-trioxohexahydro-5lambda~6~-thieno[3,4-d]imidazol-1(2H)-yl]acetamide |
| Molecular Weight: | 447.48 |
| Molecular Formula: | C21 H22 F N3 O5 S |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(N(c2ccc(cc2)F)[C@H]2CS(C[C@@H]12)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0183 |
| logD: | 2.0182 |
| logSw: | -2.8218 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.846 |
| InChI Key: | HYZINFQZNAGLIQ-RBUKOAKNSA-N |