4-bromo-N-[3-(5-methyl-1-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-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-thiadiazol-5-yl]benzamide
4-bromo-N-[3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-thiadiazol-5-yl]benzamide
Compound characteristics
| Compound ID: | G193-0241 |
| Compound Name: | 4-bromo-N-[3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-thiadiazol-5-yl]benzamide |
| Molecular Weight: | 441.31 |
| Molecular Formula: | C18 H13 Br N6 O S |
| Smiles: | Cc1c(c2nc(NC(c3ccc(cc3)[Br])=O)sn2)nnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2436 |
| logD: | 4.2087 |
| logSw: | -4.2855 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.76 |
| InChI Key: | CEOMYMBJURUHOG-UHFFFAOYSA-N |