N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide
Compound characteristics
| Compound ID: | Y031-2785 |
| Compound Name: | N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide |
| Molecular Weight: | 419.95 |
| Molecular Formula: | C19 H18 Cl N3 O2 S2 |
| Smiles: | CCCSc1ccccc1C(Nc1nnc(COc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3667 |
| logD: | 4.1028 |
| logSw: | -5.8964 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.597 |
| InChI Key: | ZSBDZLBYCIFQCG-UHFFFAOYSA-N |