2-[3-(ethylsulfanyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole
Chemical Structure Depiction of
2-[3-(ethylsulfanyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole
2-[3-(ethylsulfanyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole
Compound characteristics
| Compound ID: | 5402-0560 |
| Compound Name: | 2-[3-(ethylsulfanyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C18 H16 N4 O S2 |
| Smiles: | CCSc1nc(c2ccc(cc2)OC)n(c2nc3ccccc3s2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7353 |
| logD: | 5.7353 |
| logSw: | -5.6585 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.69 |
| InChI Key: | XLFXGYUPNVZYAB-UHFFFAOYSA-N |