N-(4-BR-PH)-2-((4-(4-BR-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)acetamide
N-(4-bromophenyl)-2-[[4-(4-bromophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(4-bromophenyl)-2-{[4-(4-bromophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(4-Bromophenyl)-2-((4-(4-bromophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-BR-PH)-2-((4-(4-BR-PH)-5-(4-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETAMIDE|N-(4-bromophenyl)-2-[[4-(4-bromophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(4-bromophenyl)-2-[4-(4-bromophenyl)-5-(4-pyridyl)(1,2,4-triazol-3-ylthio)]a cetamide|650-452-3
| Molecular Formula | C21H15Br2N5OS |
|---|---|
| Molecular Weight | 542.9364 g/mol |
| LogP | 5.5851 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 542.9364 |
| Monoisotopic Mass | 544.9344 |
| Heavy Atoms | 30 |
| Complexity | 1148.5024 |
Chemical Identifiers
| CAS Number | 477331-31-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Br)C4=CC=NC=C4)Br |
Product Overview
N-(4-BR-PH)-2-((4-(4-BR-PH)-5-(4-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)acetamide (CAS 477331-31-0), with molecular formula C21H15Br2N5OS and molecular weight 542.9364 g/mol. IUPAC: N-(4-bromophenyl)-2-[[4-(4-bromophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide.