N-[4-(cyclohexylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-[4-(cyclohexylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-[4-(cyclohexylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F913-0720 |
Compound Name: | N-[4-(cyclohexylcarbamoyl)phenyl]-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 464.59 |
Molecular Formula: | C25 H28 N4 O3 S |
Smiles: | Cc1cc(C)cc(c1)OCc1nnc(C(Nc2ccc(cc2)C(NC2CCCCC2)=O)=O)s1 |
Stereo: | ACHIRAL |
logP: | 4.9922 |
logD: | 4.9855 |
logSw: | -4.6248 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.695 |
InChI Key: | ZSSCUOVCIKHGJJ-UHFFFAOYSA-N |