5-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide
5-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide
Compound characteristics
Compound ID: | D457-0318 |
Compound Name: | 5-bromo-N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide |
Molecular Weight: | 424.27 |
Molecular Formula: | C16 H14 Br N3 O4 S |
Smiles: | [H]N(C(c1ccc(o1)[Br])=O)c1nc(c2ccc(c(c2)OC)OCC)ns1 |
Stereo: | ACHIRAL |
logP: | 4.1367 |
logD: | 4.0226 |
logSw: | -4.3461 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.684 |
InChI Key: | PPZBOYZTCBKVBP-UHFFFAOYSA-N |