AC1OJFE1
2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: F2563-0495|2-((5-propyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide|2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide|2-{[5-propyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide|N-o-(trifluoromethyl)phenyl[5-propyl-4-(1-pyrrolyl)-4H-1,2,4-triazol-3-ylthio]acetamide
| Molecular Formula | C18H18F3N5OS |
|---|---|
| Molecular Weight | 409.1184 g/mol |
| LogP | 4.0931 |
| Topological Polar Surface Area | 64.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.1184 |
| Monoisotopic Mass | 409.1184 |
| Heavy Atoms | 28 |
| Complexity | 937.1017 |
Chemical Identifiers
| CAS Number | 896299-56-2 |
|---|---|
| SMILES | CCCC1=NN=C(N1N2C=CC=C2)SCC(=O)NC3=CC=CC=C3C(F)(F)F |
Product Overview
AC1OJFE1 (CAS 896299-56-2), with molecular formula C18H18F3N5OS and molecular weight 409.1184 g/mol. IUPAC: 2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide.
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