6-[2-(4-methylphenyl)ethyl]-3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[2-(4-methylphenyl)ethyl]-3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[2-(4-methylphenyl)ethyl]-3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D228-0368 |
| Compound Name: | 6-[2-(4-methylphenyl)ethyl]-3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 350.44 |
| Molecular Formula: | C19 H18 N4 O S |
| Smiles: | Cc1ccc(CCc2nn3c(COc4ccccc4)nnc3s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9732 |
| logD: | 3.9732 |
| logSw: | -4.0636 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.692 |
| InChI Key: | TYCHBHPHEREOMY-UHFFFAOYSA-N |