N-[(5-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[(5-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
N-[(5-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | C328-0100 |
| Compound Name: | N-[(5-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 494.47 |
| Molecular Formula: | C21 H20 F2 N4 O6 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(NCc1nnc(o1)SCC(Nc1ccc(cc1F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8421 |
| logD: | 1.8338 |
| logSw: | -2.5267 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.844 |
| InChI Key: | SVADKPLQGGAWOW-UHFFFAOYSA-N |