2-(4-acetamidophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-(4-acetamidophenyl)-1,3-dioxoisoindole-5-carboxylic acid
Also Known As: Oprea1_104566|Oprea1_526590|CBDivE_003346|2-(4-acetamidophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid|BAS 00268637|2-(4-Acetylamino-phenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid|GS-9631|2-(4-acetamidophenyl)-1,3-dioxoisoindole-5-carboxylic acid|2-(4-Acetamidophenyl)-1,3-dioxoisoindoline-5-carboxylic acid|2-(4-acetamidophenyl)-1,3-dioxo-isoindoline-5-carboxylic acid|2-[4-(Acetylamino)phenyl]-1,3-dioxo-5-isoindolinecarboxylic acid|2-[4-(Acetylamino)phenyl]-2,3-dihydro-1,3-dioxo-1H-isoindole-5-carboxylic acid|2-[4-(acetylamino)phenyl]-1,3-dioxobenzo[c]azoline-5-carboxylic acid|
2-(4-Acetylamino-phenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic ac id|2-[4-(acetylamino)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
| Molecular Formula | C17H12N2O5 |
|---|---|
| Molecular Weight | 324.07462 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.07462 |
| Monoisotopic Mass | 324.07462 |
| Heavy Atoms | 24 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 49587-52-2 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O |
| InChIKey | PSZQNXKRIHBZKI-UHFFFAOYSA-N |
Product Overview
2-(4-acetamidophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid (CAS 49587-52-2), with molecular formula C17H12N2O5 and molecular weight 324.07462 g/mol. IUPAC: 2-(4-acetamidophenyl)-1,3-dioxoisoindole-5-carboxylic acid.