N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-iodobenzamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-iodobenzamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-iodobenzamide
Compound characteristics
| Compound ID: | 8010-5647 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-iodobenzamide |
| Molecular Weight: | 481.31 |
| Molecular Formula: | C18 H16 I N3 O3 S |
| Smiles: | COc1ccc(Cc2nnc(NC(c3cccc(c3)I)=O)s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.4665 |
| logD: | 3.5084 |
| logSw: | -4.4204 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.359 |
| InChI Key: | NHTCYHCFTRSCCI-UHFFFAOYSA-N |