N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F913-0454 |
Compound Name: | N-[4-(cyclopropylcarbamoyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 408.48 |
Molecular Formula: | C21 H20 N4 O3 S |
Smiles: | Cc1cccc(c1)OCc1nnc(C(Nc2ccc(cc2)C(NC2CC2)=O)=O)s1 |
Stereo: | ACHIRAL |
logP: | 3.2134 |
logD: | 3.2067 |
logSw: | -3.4669 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.026 |
InChI Key: | ZCYWUDXOLBQRHD-UHFFFAOYSA-N |