N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(ethylsulfanyl)benzamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(ethylsulfanyl)benzamide
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(ethylsulfanyl)benzamide
Compound characteristics
| Compound ID: | Y030-9956 |
| Compound Name: | N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(ethylsulfanyl)benzamide |
| Molecular Weight: | 405.92 |
| Molecular Formula: | C18 H16 Cl N3 O2 S2 |
| Smiles: | CCSc1ccccc1C(Nc1nnc(COc2ccc(cc2)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9536 |
| logD: | 3.6897 |
| logSw: | -4.951 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.597 |
| InChI Key: | XHLMUNQKPDZCFQ-UHFFFAOYSA-N |