4-bromo-N-{3-[1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
Chemical Structure Depiction of
4-bromo-N-{3-[1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
4-bromo-N-{3-[1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide
Compound characteristics
| Compound ID: | G193-0249 |
| Compound Name: | 4-bromo-N-{3-[1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}benzamide |
| Molecular Weight: | 459.3 |
| Molecular Formula: | C18 H12 Br F N6 O S |
| Smiles: | Cc1c(c2nc(NC(c3ccc(cc3)[Br])=O)sn2)nnn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 4.4356 |
| logD: | 4.4007 |
| logSw: | -4.3442 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.76 |
| InChI Key: | BIOQATXHIXFUTJ-UHFFFAOYSA-N |