N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide
Compound characteristics
| Compound ID: | Y030-9305 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C22 H24 N4 O4 S |
| Smiles: | CC(C)C(Nc1ccc(cc1)C(Nc1nnc(Cc2ccc(c(c2)OC)OC)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5263 |
| logD: | 3.1084 |
| logSw: | -3.8046 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.722 |
| InChI Key: | RJCYJIJOFFITKD-UHFFFAOYSA-N |