3,4,5-trimethoxy-N-{[5-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-{[5-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide
3,4,5-trimethoxy-N-{[5-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C328-0101 |
| Compound Name: | 3,4,5-trimethoxy-N-{[5-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}benzamide |
| Molecular Weight: | 542.49 |
| Molecular Formula: | C22 H21 F3 N4 O7 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(NCc1nnc(o1)SCC(Nc1ccc(cc1)OC(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1174 |
| logD: | 3.1174 |
| logSw: | -3.759 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.479 |
| InChI Key: | SKYMRFUSOPLEBB-UHFFFAOYSA-N |