5-(4-{[(4-ethylphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[(4-ethylphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(4-{[(4-ethylphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0389 |
| Compound Name: | 5-(4-{[(4-ethylphenyl)methyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | CCc1ccc(CNC(CCCc2nnc(C(Nc3ccc(C)cc3)=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1838 |
| logD: | 4.1837 |
| logSw: | -4.0972 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.529 |
| InChI Key: | XFOWXXGBOVUCIB-UHFFFAOYSA-N |