N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluoro-4-methylbenzamide
Chemical Structure Depiction of
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluoro-4-methylbenzamide
N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluoro-4-methylbenzamide
Compound characteristics
| Compound ID: | G952-3585 |
| Compound Name: | N-[3-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3-fluoro-4-methylbenzamide |
| Molecular Weight: | 387.82 |
| Molecular Formula: | C17 H11 Cl F N5 O S |
| Smiles: | Cc1ccc(cc1F)C(Nc1nn2c(c3ccc(cc3)[Cl])nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5669 |
| logD: | 4.3466 |
| logSw: | -4.7686 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.125 |
| InChI Key: | MWDQEMTYMTUVPU-UHFFFAOYSA-N |