N-[4-(benzylcarbamoyl)phenyl]-5-[(3,4-dimethoxyphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-[4-(benzylcarbamoyl)phenyl]-5-[(3,4-dimethoxyphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-[4-(benzylcarbamoyl)phenyl]-5-[(3,4-dimethoxyphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0740 |
| Compound Name: | N-[4-(benzylcarbamoyl)phenyl]-5-[(3,4-dimethoxyphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 504.56 |
| Molecular Formula: | C26 H24 N4 O5 S |
| Smiles: | COc1ccc(cc1OC)OCc1nnc(C(Nc2ccc(cc2)C(NCc2ccccc2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.2141 |
| logD: | 3.2074 |
| logSw: | -3.6435 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.231 |
| InChI Key: | AHADGOGMNJBEHP-UHFFFAOYSA-N |