6-[(4-chlorophenoxy)methyl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[(4-chlorophenoxy)methyl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[(4-chlorophenoxy)methyl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D727-0134 |
| Compound Name: | 6-[(4-chlorophenoxy)methyl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 348.83 |
| Molecular Formula: | C14 H9 Cl N4 O S2 |
| Smiles: | C(c1nn2c(c3cccs3)nnc2s1)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7593 |
| logD: | 3.7593 |
| logSw: | -4.3095 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.734 |
| InChI Key: | YXJYQDBAHHSNCH-UHFFFAOYSA-N |