5-(4-{[(4-ethoxyphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[(4-ethoxyphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(4-{[(4-ethoxyphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0360 |
| Compound Name: | 5-(4-{[(4-ethoxyphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | CCOc1ccc(CNC(CCCc2nnc(C(Nc3ccc(C)cc3)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6221 |
| logD: | 3.622 |
| logSw: | -3.7285 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.652 |
| InChI Key: | XNYSJZAHBUOFNK-UHFFFAOYSA-N |