2-[1-(3-Nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid
2-[1-(3-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid
Also Known As: VU0507565-1|AS-871/43476038|SR-01000292942-1|2-((1-(3-nitrophenyl)-2,5-dioxopyrrolidin-3-yl)thio)nicotinic acid|2-[1-(3-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid|2-{[1-(3-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}pyridine-3-carboxylic acid|2-{[1-(3-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl]sulfanyl}nicotinic acid|2-[1-(3-nitrophenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylpyridine-3-carboxylic Acid|2-[1-(3-nitrophenyl)-2,5-dioxoazolidin-3-ylthio]pyridine-3-carboxylic acid
| Molecular Formula | C16H11N3O6S |
|---|---|
| Molecular Weight | 373.03687 g/mol |
| LogP | 2.1122 |
| Topological Polar Surface Area | 130.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.03687 |
| Monoisotopic Mass | 373.03687 |
| Heavy Atoms | 26 |
| Complexity | 931.70605 |
Chemical Identifiers
| CAS Number | 830348-50-0 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])SC3=C(C=CC=N3)C(=O)O |
Product Overview
2-[1-(3-Nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid (CAS 830348-50-0), with molecular formula C16H11N3O6S and molecular weight 373.03687 g/mol. IUPAC: 2-[1-(3-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid.