N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-2,4-dichlorobenzamide
Chemical Structure Depiction of
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-2,4-dichlorobenzamide
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-2,4-dichlorobenzamide
Compound characteristics
| Compound ID: | 3388-0880 |
| Compound Name: | N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-2,4-dichlorobenzamide |
| Molecular Weight: | 410.34 |
| Molecular Formula: | C17 H13 Cl2 N3 O S2 |
| Smiles: | C(c1ccccc1)SCc1nnc(NC(c2ccc(cc2[Cl])[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.3902 |
| logD: | 2.8374 |
| logSw: | -6.0204 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.098 |
| InChI Key: | YIIBFZHBQVQVAO-UHFFFAOYSA-N |