2-{2-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1,3-benzothiazole
Chemical Structure Depiction of
2-{2-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1,3-benzothiazole
2-{2-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1,3-benzothiazole
Compound characteristics
| Compound ID: | 8019-5638 |
| Compound Name: | 2-{2-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1,3-benzothiazole |
| Molecular Weight: | 393.49 |
| Molecular Formula: | C19 H15 N5 O S2 |
| Smiles: | COc1ccc(cc1)c1nnc2n1nc(CCc1nc3ccccc3s1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.449 |
| logD: | 4.449 |
| logSw: | -4.3977 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.976 |
| InChI Key: | CUQNTOVEODQHEF-UHFFFAOYSA-N |