3-benzamido-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3-benzamido-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
3-benzamido-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | Y031-3358 |
| Compound Name: | 3-benzamido-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C25 H22 N4 O3 S |
| Smiles: | COc1ccc(CCc2nnc(NC(c3cccc(c3)NC(c3ccccc3)=O)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2727 |
| logD: | 4.5113 |
| logSw: | -5.2598 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.733 |
| InChI Key: | HBNIBMPJNVBSAG-UHFFFAOYSA-N |