N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide
N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | G193-0587 |
| Compound Name: | N-{3-[1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide |
| Molecular Weight: | 471.33 |
| Molecular Formula: | C19 H15 Br N6 O2 S |
| Smiles: | Cc1c(c2nc(NC(c3ccccc3OC)=O)sn2)nnn1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.1902 |
| logD: | 4.1167 |
| logSw: | -4.489 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.391 |
| InChI Key: | OTNPVSVDPCUIQA-UHFFFAOYSA-N |