5-[(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F736-0976 |
Compound Name: | 5-[(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 442.56 |
Molecular Formula: | C21 H22 N4 O3 S2 |
Smiles: | CCOc1ccc(CNC(CSc2nnc(C(Nc3ccc(C)cc3)=O)s2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.9468 |
logD: | 3.9468 |
logSw: | -3.8217 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.518 |
InChI Key: | MZQGHEAGKCFMGX-UHFFFAOYSA-N |