3-[(4-fluoroanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
Chemical Structure Depiction of
3-[(4-fluoroanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
3-[(4-fluoroanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
Compound characteristics
| Compound ID: | 8009-4324 |
| Compound Name: | 3-[(4-fluoroanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione |
| Molecular Weight: | 391.42 |
| Molecular Formula: | C18 H18 F N3 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)C1=NN(CNc2ccc(cc2)F)C(O1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.4329 |
| logD: | 3.4329 |
| logSw: | -3.9132 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.326 |
| InChI Key: | PPPSUQUFPBWDQK-UHFFFAOYSA-N |