AC1Q24XT
N-(4-bromophenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(4-bromophenyl)-2-{[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(4-bromophenyl)-2-[5-(2-furyl)-4-(2-furylmethyl)(1,2,4-triazol-3-ylthio)]ace tamide|N-(4-bromophenyl)-2-((5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-bromophenyl)-2-[[5-(2-furyl)-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(4-bromophenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C19H15BrN4O3S |
|---|---|
| Molecular Weight | 458.00482 g/mol |
| LogP | 4.6727 |
| Topological Polar Surface Area | 86.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 458.00482 |
| Monoisotopic Mass | 458.00482 |
| Heavy Atoms | 28 |
| Complexity | 1043.7557 |
Chemical Identifiers
| CAS Number | 577960-66-8 |
|---|---|
| SMILES | C1=COC(=C1)CN2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=CO4 |
Product Overview
AC1Q24XT (CAS 577960-66-8), with molecular formula C19H15BrN4O3S and molecular weight 458.00482 g/mol. IUPAC: N-(4-bromophenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.