ethyl 4-(4-methoxyphenyl)-2-{2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-methoxyphenyl)-2-{2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate
ethyl 4-(4-methoxyphenyl)-2-{2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4112-4042 |
| Compound Name: | ethyl 4-(4-methoxyphenyl)-2-{2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 524.64 |
| Molecular Formula: | C24 H20 N4 O4 S3 |
| Smiles: | CCOC(c1c(csc1NC(CSc1nnc2n1c1ccccc1s2)=O)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0323 |
| logD: | 5.0215 |
| logSw: | -4.6869 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.276 |
| InChI Key: | LFRSIUIVUXILJD-UHFFFAOYSA-N |