AC1M5QL3
1-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone
Also Known As: 1-[1-(4-ethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone|1-[1-(4-ethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-({8-methyl-2,4,5-triazatricyclo[7.4.0.0^{2,6}]trideca-1(9),3,5,7,10,12-hexaen-3-yl}sulfanyl)ethan-1-one|1-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-(5-methyl(10-hydro-1,2,4-tria zolo[4,3-a]quinolinylthio))ethan-1-one|1-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone
| Molecular Formula | C27H26N4O2S |
|---|---|
| Molecular Weight | 470.17764 g/mol |
| LogP | 5.97216 |
| Topological Polar Surface Area | 61.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.17764 |
| Monoisotopic Mass | 470.17764 |
| Heavy Atoms | 34 |
| Complexity | 1515.7667 |
Chemical Identifiers
| CAS Number | 501348-95-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)CSC3=NN=C4N3C5=CC=CC=C5C(=C4)C)C |
Product Overview
AC1M5QL3 (CAS 501348-95-4), with molecular formula C27H26N4O2S and molecular weight 470.17764 g/mol. IUPAC: 1-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone.