2-bromo-N-[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Chemical Structure Depiction of
2-bromo-N-[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
2-bromo-N-[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | F019-5718 |
| Compound Name: | 2-bromo-N-[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide |
| Molecular Weight: | 400.25 |
| Molecular Formula: | C16 H10 Br N5 O S |
| Smiles: | c1ccc(c(c1)C(Nc1ccc(cc1)c1nn2cnnc2s1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7593 |
| logD: | 2.759 |
| logSw: | -3.7756 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.735 |
| InChI Key: | JNYVCGDFSHRAHX-UHFFFAOYSA-N |