AC1Q3IEG
N-(3-chlorophenyl)-2-[[4-(furan-2-ylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(3-chlorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(3-chlorophenyl)-2-((4-(furan-2-ylmethyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(3-chlorophenyl)-2-[[4-(2-furylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(3-chlorophenyl)-2-[[4-(furan-2-ylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(3-chlorophenyl)-2-[4-(2-furylmethyl)-5-(2-pyridyl)(1,2,4-triazol-3-ylthio)] acetamide
| Molecular Formula | C20H16ClN5O2S |
|---|---|
| Molecular Weight | 425.07132 g/mol |
| LogP | 4.3656 |
| Topological Polar Surface Area | 85.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.07132 |
| Monoisotopic Mass | 425.07132 |
| Heavy Atoms | 29 |
| Complexity | 1099.2842 |
Chemical Identifiers
| CAS Number | 681007-48-7 |
|---|---|
| SMILES | C1=CC=NC(=C1)C2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC(=CC=C4)Cl |
Product Overview
AC1Q3IEG (CAS 681007-48-7), with molecular formula C20H16ClN5O2S and molecular weight 425.07132 g/mol. IUPAC: N-(3-chlorophenyl)-2-[[4-(furan-2-ylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide.