AC1LXJSH
N-(3-fluoro-4-methylphenyl)-2-[[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(3-fluoro-4-methylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(3-fluoro-4-methylphenyl)-2-((4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(3-fluoro-4-methylphenyl)-2-[[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(3-fluoro-4-methylphenyl)-2-[4-(2-furylmethyl)-5-(phenoxymethyl)(1,2,4-triaz ol-3-ylthio)]acetamide
| Molecular Formula | C23H21FN4O3S |
|---|---|
| Molecular Weight | 452.13184 g/mol |
| LogP | 4.67672 |
| Topological Polar Surface Area | 82.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 452.13184 |
| Monoisotopic Mass | 452.13184 |
| Heavy Atoms | 32 |
| Complexity | 1179.4419 |
Chemical Identifiers
| CAS Number | 896830-66-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)COC4=CC=CC=C4)F |
Product Overview
AC1LXJSH (CAS 896830-66-3), with molecular formula C23H21FN4O3S and molecular weight 452.13184 g/mol. IUPAC: N-(3-fluoro-4-methylphenyl)-2-[[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.