N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide
Compound characteristics
| Compound ID: | Y032-4044 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-(propylsulfanyl)benzamide |
| Molecular Weight: | 403.95 |
| Molecular Formula: | C19 H18 Cl N3 O S2 |
| Smiles: | CCCSc1ccccc1C(Nc1nnc(Cc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5556 |
| logD: | 5.0727 |
| logSw: | -5.8813 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.098 |
| InChI Key: | ZPBOFTBOEPSVSC-UHFFFAOYSA-N |