N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | G193-0347 |
| Compound Name: | N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide |
| Molecular Weight: | 447.33 |
| Molecular Formula: | C16 H11 Br N6 O S2 |
| Smiles: | Cc1c(c2nc(NC(c3cccs3)=O)sn2)nnn1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.2777 |
| logD: | 4.2772 |
| logSw: | -4.2848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.779 |
| InChI Key: | JTKDQKDVGLKLOR-UHFFFAOYSA-N |