3-(4-chlorophenyl)-6-(4-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(4-chlorophenyl)-6-(4-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(4-chlorophenyl)-6-(4-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8019-5613 |
| Compound Name: | 3-(4-chlorophenyl)-6-(4-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 357.78 |
| Molecular Formula: | C15 H8 Cl N5 O2 S |
| Smiles: | c1cc(ccc1c1nnc2n1nc(c1ccc(cc1)[N+]([O-])=O)s2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2301 |
| logD: | 4.2301 |
| logSw: | -4.7623 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.103 |
| InChI Key: | DUQKSSABMIQRDX-UHFFFAOYSA-N |