N-{[5-({2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{[5-({2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-3,4,5-trimethoxybenzamide
N-{[5-({2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | C328-0081 |
| Compound Name: | N-{[5-({2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 560.94 |
| Molecular Formula: | C22 H20 Cl F3 N4 O6 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(NCc1nnc(o1)SCC(Nc1cc(ccc1[Cl])C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1511 |
| logD: | 3.1184 |
| logSw: | -3.6796 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.844 |
| InChI Key: | VRJDWWMCAYWGTE-UHFFFAOYSA-N |