5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-methyl-1-benzofuran-2-carboxamide
5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D381-0190 |
| Compound Name: | 5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 474.33 |
| Molecular Formula: | C20 H16 Br N3 O4 S |
| Smiles: | [H]N(C(c1c(C)c2cc(ccc2o1)[Br])=O)c1nc(c2ccc(c(c2)OC)OC)ns1 |
| Stereo: | ACHIRAL |
| logP: | 5.4964 |
| logD: | 5.4863 |
| logSw: | -5.6125 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.704 |
| InChI Key: | PWIHXNAMPYEBAQ-UHFFFAOYSA-N |