3-iodo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3-iodo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
3-iodo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | Y030-7053 |
| Compound Name: | 3-iodo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 451.28 |
| Molecular Formula: | C17 H14 I N3 O2 S |
| Smiles: | COc1ccc(Cc2nnc(NC(c3cccc(c3)I)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8303 |
| logD: | 3.8722 |
| logSw: | -4.6919 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.642 |
| InChI Key: | QTDIFXOLBJHTQM-UHFFFAOYSA-N |