3,4-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
3,4-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
3,4-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D421-1809 |
| Compound Name: | 3,4-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C20 H19 N3 O4 S |
| Smiles: | Cc1ccc(cc1C)OC(CSc1nnc(CNC(c2ccccc2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2668 |
| logD: | 3.2668 |
| logSw: | -3.5922 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.469 |
| InChI Key: | QKXWIISKTPUDJU-UHFFFAOYSA-N |