3,4-dimethoxy-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
3,4-dimethoxy-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | 2900-0096 |
| Compound Name: | 3,4-dimethoxy-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C20 H21 N3 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(CCc1nnc(NC(c2ccc(c(c2)OC)OC)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0496 |
| logD: | 2.8593 |
| logSw: | -3.5587 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.395 |
| InChI Key: | PKJBNGAXBFXCLF-UHFFFAOYSA-N |