3,4-dimethoxy-N-{[5-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-{[5-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide
3,4-dimethoxy-N-{[5-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C328-0499 |
| Compound Name: | 3,4-dimethoxy-N-{[5-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide |
| Molecular Weight: | 496.46 |
| Molecular Formula: | C21 H19 F3 N4 O5 S |
| Smiles: | COc1ccc(cc1OC)C(NCc1nnc(o1)SCC(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8129 |
| logD: | 2.8124 |
| logSw: | -3.4952 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.825 |
| InChI Key: | QKGKGUPGJDZYQF-UHFFFAOYSA-N |