3-[(2-chloroanilino)methyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
Chemical Structure Depiction of
3-[(2-chloroanilino)methyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
3-[(2-chloroanilino)methyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
Compound characteristics
| Compound ID: | 3448-9141 |
| Compound Name: | 3-[(2-chloroanilino)methyl]-5-(4-ethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione |
| Molecular Weight: | 361.85 |
| Molecular Formula: | C17 H16 Cl N3 O2 S |
| Smiles: | CCOc1ccc(cc1)C1=NN(CNc2ccccc2[Cl])C(O1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.4505 |
| logD: | 4.4505 |
| logSw: | -4.5474 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.774 |
| InChI Key: | GTBRIHOUFOEHNT-UHFFFAOYSA-N |