3-benzamido-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-benzamido-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide--hydrogen chloride (1/1)
3-benzamido-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 6040-4064 |
| Compound Name: | 3-benzamido-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C24 H20 N4 O3 S |
| Salt: | HCl |
| Smiles: | COc1ccc(Cc2nnc(NC(c3cccc(c3)NC(c3ccccc3)=O)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7457 |
| logD: | 4.4155 |
| logSw: | -4.601 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.733 |
| InChI Key: | JYXLZLGVYSFLGG-UHFFFAOYSA-N |