5-[(4-methylphenoxy)methyl]-N-{3-[(2-methylphenyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(4-methylphenoxy)methyl]-N-{3-[(2-methylphenyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide
5-[(4-methylphenoxy)methyl]-N-{3-[(2-methylphenyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F912-1068 |
| Compound Name: | 5-[(4-methylphenoxy)methyl]-N-{3-[(2-methylphenyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C25 H22 N4 O3 S |
| Smiles: | Cc1ccc(cc1)OCc1nnc(C(Nc2cccc(c2)C(Nc2ccccc2C)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8279 |
| logD: | 4.8274 |
| logSw: | -4.5336 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.95 |
| InChI Key: | VBMUALZBYPUZCN-UHFFFAOYSA-N |