N~2~-[(4-ethoxy-3-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-[(4-ethoxy-3-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-[(4-ethoxy-3-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
Compound ID: | G675-0268 |
Compound Name: | N~2~-[(4-ethoxy-3-methoxyphenyl)methyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide |
Molecular Weight: | 442.49 |
Molecular Formula: | C21 H22 N4 O5 S |
Smiles: | CCOc1ccc(CNC(c2nnc(C(Nc3ccc(cc3)OC)=O)s2)=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 2.6244 |
logD: | 2.6229 |
logSw: | -3.2261 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 93.631 |
InChI Key: | CGFRSFXUMBHXQO-UHFFFAOYSA-N |