4-butyl-N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-butyl-N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexane-1-carboxamide
4-butyl-N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G952-0855 |
| Compound Name: | 4-butyl-N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexane-1-carboxamide |
| Molecular Weight: | 417.96 |
| Molecular Formula: | C20 H24 Cl N5 O S |
| Smiles: | CCCCC1CCC(CC1)C(Nc1nn2c(c3ccc(cc3)[Cl])nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9613 |
| logD: | 5.9574 |
| logSw: | -6.1805 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.317 |
| InChI Key: | VYCBJHJXMXXSHX-UHFFFAOYSA-N |