3-(5-chloro-2-methoxyphenyl)-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(5-chloro-2-methoxyphenyl)-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(5-chloro-2-methoxyphenyl)-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8019-6859 |
| Compound Name: | 3-(5-chloro-2-methoxyphenyl)-6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 402.86 |
| Molecular Formula: | C18 H15 Cl N4 O3 S |
| Smiles: | COc1ccc(cc1c1nnc2n1nc(c1ccc(c(c1)OC)OC)s2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5891 |
| logD: | 3.5891 |
| logSw: | -4.1022 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.613 |
| InChI Key: | BXESDBNDSJHECW-UHFFFAOYSA-N |