AC1LLLQA
N-(furan-2-ylmethyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBMicro_044519|BAS 09615514|BIM-0044663.P001|N-[(Furan-2-yl)methyl]-2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|AF-399/14182002|SR-01000441983-1|F0723-0019|N-(furan-2-ylmethyl)-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(furan-2-ylmethyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide|N-(2-furylmethyl)-2-(4-phenyl-5-(4-pyridyl)(1,2,4-triazol-3-ylthio))acetamide|N-(2-furylmethyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(2-furylmethyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}acetamide|N-((Furan-2-yl)methyl)-2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)sulfanyl)acetamide|N-(furan-2-ylmethyl)-2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C20H17N5O2S |
|---|---|
| Molecular Weight | 391.1103 g/mol |
| LogP | 3.3308 |
| Topological Polar Surface Area | 85.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.1103 |
| Monoisotopic Mass | 391.1103 |
| Heavy Atoms | 28 |
| Complexity | 1033.1753 |
Chemical Identifiers
| CAS Number | 6079-72-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC3=CC=CO3)C4=CC=NC=C4 |
Product Overview
AC1LLLQA (CAS 6079-72-7), with molecular formula C20H17N5O2S and molecular weight 391.1103 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.