3-[(4-tert-butylphenoxy)methyl]-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
3-[(4-tert-butylphenoxy)methyl]-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-[(4-tert-butylphenoxy)methyl]-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | 8012-9858 |
| Compound Name: | 3-[(4-tert-butylphenoxy)methyl]-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 412.94 |
| Molecular Formula: | C21 H21 Cl N4 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)OCc1nnc2n1N=C(CS2)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.802 |
| logD: | 5.6366 |
| logSw: | -6.2387 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.433 |
| InChI Key: | UGLCBRNFHHQKNM-UHFFFAOYSA-N |