6-(phenoxymethyl)-3-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(phenoxymethyl)-3-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(phenoxymethyl)-3-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0186 |
| Compound Name: | 6-(phenoxymethyl)-3-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C19 H18 N4 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)c1nnc2n1nc(COc1ccccc1)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.8981 |
| logD: | 2.898 |
| logSw: | -3.2009 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.694 |
| InChI Key: | CIXVQTDZALQUMB-UHFFFAOYSA-N |