2-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide
Chemical Structure Depiction of
2-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide
2-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide
Compound characteristics
| Compound ID: | D457-0225 |
| Compound Name: | 2-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide |
| Molecular Weight: | 434.31 |
| Molecular Formula: | C18 H16 Br N3 O3 S |
| Smiles: | [H]N(C(c1ccccc1[Br])=O)c1nc(c2ccc(c(c2)OC)OCC)ns1 |
| Stereo: | ACHIRAL |
| logP: | 4.3087 |
| logD: | 4.2646 |
| logSw: | -4.3281 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.758 |
| InChI Key: | ROTBPALAIIAXHE-UHFFFAOYSA-N |