5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide
5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide
Compound characteristics
Compound ID: | D381-0181 |
Compound Name: | 5-bromo-N-[3-(3,4-dimethoxyphenyl)-1,2,4-thiadiazol-5-yl]furan-2-carboxamide |
Molecular Weight: | 410.24 |
Molecular Formula: | C15 H12 Br N3 O4 S |
Smiles: | [H]N(C(c1ccc(o1)[Br])=O)c1nc(c2ccc(c(c2)OC)OC)ns1 |
Stereo: | ACHIRAL |
logP: | 3.7911 |
logD: | 3.677 |
logSw: | -4.169 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.104 |
InChI Key: | HQCFMYZAJOBIEH-UHFFFAOYSA-N |