N-{5-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{5-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-3,4-dimethoxybenzamide
N-{5-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | 2900-0097 |
| Compound Name: | N-{5-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 467.95 |
| Molecular Formula: | C19 H18 Cl N3 O5 S2 |
| Smiles: | COc1ccc(cc1OC)C(Nc1nnc(CCS(c2ccc(cc2)[Cl])(=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2209 |
| logD: | 3.0307 |
| logSw: | -3.8143 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.395 |
| InChI Key: | KDMJBPUJNPISBR-UHFFFAOYSA-N |