N~2~-[(5-bromo-2-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-[(5-bromo-2-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-[(5-bromo-2-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
Compound ID: | G675-0274 |
Compound Name: | N~2~-[(5-bromo-2-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide |
Molecular Weight: | 477.33 |
Molecular Formula: | C19 H17 Br N4 O4 S |
Smiles: | COc1ccc(cc1)NC(c1nnc(C(NCc2cc(ccc2OC)[Br])=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.5572 |
logD: | 3.5557 |
logSw: | -3.8598 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.421 |
InChI Key: | JWXMKJGKWUZHMW-UHFFFAOYSA-N |