N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0694 |
| Compound Name: | N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | Cc1cc(C)cc(c1)OCc1nnc(C(Nc2ccc(cc2)C(NC2CC2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.6052 |
| logD: | 3.5985 |
| logSw: | -3.8892 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.026 |
| InChI Key: | PBRDJTVDDAOATP-UHFFFAOYSA-N |