3-chloro-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-6-methyl-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-6-methyl-1-benzothiophene-2-carboxamide
3-chloro-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-6-methyl-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | D381-0183 |
| Compound Name: | 3-chloro-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-6-methyl-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 445.94 |
| Molecular Formula: | C20 H16 Cl N3 O3 S2 |
| Smiles: | [H]N(C(c1c(c2ccc(C)cc2s1)[Cl])=O)c1nc(c2ccc(c(c2)OC)OC)ns1 |
| Stereo: | ACHIRAL |
| logP: | 5.8446 |
| logD: | 5.8355 |
| logSw: | -6.2814 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.925 |
| InChI Key: | YSXQIQCIFFBHGB-UHFFFAOYSA-N |