4-bromo-N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide
Chemical Structure Depiction of
4-bromo-N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide
4-bromo-N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide
Compound characteristics
| Compound ID: | G193-0281 |
| Compound Name: | 4-bromo-N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide |
| Molecular Weight: | 487.4 |
| Molecular Formula: | C19 H15 Br N6 O S2 |
| Smiles: | Cc1c(c2nc(NC(c3ccc(cc3)[Br])=O)sn2)nnn1c1cccc(c1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.7884 |
| logD: | 4.7535 |
| logSw: | -4.5931 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.76 |
| InChI Key: | RMAMKRKJKUSABI-UHFFFAOYSA-N |