rel-(3aR,6aS)-1-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione
Chemical Structure Depiction of
rel-(3aR,6aS)-1-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione
rel-(3aR,6aS)-1-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione
Compound characteristics
| Compound ID: | D110-0163 |
| Compound Name: | rel-(3aR,6aS)-1-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydro-5lambda~6~-thieno[3,4-d]imidazole-2,5,5(1H,3H)-trione |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C19 H20 N2 O5 S |
| Smiles: | COc1ccc(cc1)N1C(N(c2ccccc2OC)[C@H]2CS(C[C@@H]12)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7189 |
| logD: | 1.7189 |
| logSw: | -2.2354 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.835 |
| InChI Key: | GHXGXOXZNCQWAR-UHFFFAOYSA-N |