3,5-dimethoxy-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3,5-dimethoxy-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
3,5-dimethoxy-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | D294-1015 |
| Compound Name: | 3,5-dimethoxy-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | Cc1ccccc1N1CC(CC1=O)c1nnc(NC(c2cc(cc(c2)OC)OC)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8184 |
| logD: | 3.6473 |
| logSw: | -4.0359 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.14 |
| InChI Key: | SIMSTMFAZMKWLK-HNNXBMFYSA-N |