N-(4-bromo-3-chlorophenyl)-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromo-3-chlorophenyl)-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(4-bromo-3-chlorophenyl)-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F019-0359 |
| Compound Name: | N-(4-bromo-3-chlorophenyl)-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 499.82 |
| Molecular Formula: | C22 H16 Br Cl N4 O S |
| Smiles: | C(C(Nc1ccc(c(c1)[Cl])[Br])=O)Sc1nnc(c2ccccc2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0232 |
| logD: | 6.0166 |
| logSw: | -6.1847 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.862 |
| InChI Key: | UOAZAESNWWRGMQ-UHFFFAOYSA-N |