N-(4-methylphenyl)-5-(4-{[(4-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-5-(4-{[(4-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-methylphenyl)-5-(4-{[(4-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0235 |
| Compound Name: | N-(4-methylphenyl)-5-(4-{[(4-methylphenyl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C22 H24 N4 O2 S |
| Smiles: | Cc1ccc(CNC(CCCc2nnc(C(Nc3ccc(C)cc3)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6765 |
| logD: | 3.6764 |
| logSw: | -3.8487 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.529 |
| InChI Key: | WQQPNTUZIPNGEC-UHFFFAOYSA-N |