RefChem:823335
N-(1,3-benzodioxol-5-yl)-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: AQ-386/41325675|N-(1,3-benzodioxol-5-yl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(1,3-benzodioxol-5-yl)-2-{[4-(4-ethoxyphenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(Benzo[d][1,3]dioxol-5-yl)-2-((4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide|650-454-4|N-(1,3-Benzodioxol-5-YL)-2-((4-(4-ethoxyphenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)sulfanyl)acetamide|N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-2-[4-(4-ethoxyphenyl)-5-(3-pyridyl)(1,2,4 -triazol-3-ylthio)]acetamide
| Molecular Formula | C24H21N5O4S |
|---|---|
| Molecular Weight | 475.13144 g/mol |
| LogP | 4.1875 |
| Topological Polar Surface Area | 100.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 475.13144 |
| Monoisotopic Mass | 475.13144 |
| Heavy Atoms | 34 |
| Complexity | 1294.7285 |
Chemical Identifiers
| CAS Number | 477331-29-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CN=CC=C5 |
Product Overview
RefChem:823335 (CAS 477331-29-6), with molecular formula C24H21N5O4S and molecular weight 475.13144 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide.