AC1N69OS
N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide
Also Known As: F0508-3589|N-(4-methoxyphenyl)-2-[(5-{[2-(4-methoxyphenyl)acetamido]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide|N-(4-methoxyphenyl)-2-((5-((2-(4-methoxyphenyl)acetamido)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamide|N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide|N-p-methoxyphenyl[5-({[(p-methoxyphenyl)methyl]carbonylamino}methyl)-4-phenyl-4H-1,2,4-triazol-3-ylthio]acetamide
| Molecular Formula | C27H27N5O4S |
|---|---|
| Molecular Weight | 517.1784 g/mol |
| LogP | 3.8742 |
| Topological Polar Surface Area | 107.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 517.1784 |
| Monoisotopic Mass | 517.1784 |
| Heavy Atoms | 37 |
| Complexity | 1242.4309 |
Chemical Identifiers
| CAS Number | 392679-95-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)OC |
Product Overview
AC1N69OS (CAS 392679-95-7), with molecular formula C27H27N5O4S and molecular weight 517.1784 g/mol. IUPAC: N-[[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide.
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