AC1MGPR3
2-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid
Also Known As: BAS 07438801|AB00319772-02|2-((1-(4-chloro-3-(trifluoromethyl)phenyl)-2,5-dioxopyrrolidin-3-yl)thio)nicotinic acid|2-({1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)pyridine-3-carboxylic acid|2-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid|2-{1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dioxoazolidin-3-ylthio}pyridine- 3-carboxylic acid
| Molecular Formula | C17H10ClF3N2O4S |
|---|---|
| Molecular Weight | 430.00018 g/mol |
| LogP | 3.8762 |
| Topological Polar Surface Area | 87.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.00018 |
| Monoisotopic Mass | 430.00018 |
| Heavy Atoms | 28 |
| Complexity | 983.1151 |
Chemical Identifiers
| CAS Number | 670255-07-9 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)C2=CC(=C(C=C2)Cl)C(F)(F)F)SC3=C(C=CC=N3)C(=O)O |
Product Overview
AC1MGPR3 (CAS 670255-07-9), with molecular formula C17H10ClF3N2O4S and molecular weight 430.00018 g/mol. IUPAC: 2-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid.
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