2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid
TL;DR: 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid (CAS 6327-13-5) is a chemical compound with molecular formula C17H12N2O6 and molecular weight 340.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)-3-(4-nitrophenyl)propanoic acid
Also Known As: (RS)-N-Phthaloyl-p-nitrophenylalanine, 2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid, 2-(1,3-dioxoisoindol-2-yl)-3-(4-nitrophenyl)propanoic acid
| Molecular Formula | C17H12N2O6 |
|---|---|
| Molecular Weight | 340.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.06955 |
| Heavy Atoms | 25 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 6327-13-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)C(CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O |
| InChIKey | HVFGSPHUECNWHF-UHFFFAOYSA-N |
Product Overview
2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid (CAS 6327-13-5), with molecular formula C17H12N2O6 and molecular weight 340.07 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)-3-(4-nitrophenyl)propanoic acid.
Chemical Property Profile of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid
Property Insights of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid. Following Lipinski's Rule of Five, 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid?
The CAS number of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid is 6327-13-5.
What is the molecular formula of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid?
The molecular formula of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid is C17H12N2O6.
What is the molecular weight of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid?
The molecular weight of 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid is 340.07 g/mol.
Where can I buy 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid?
You can request a quote for 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Dioxo-1,3-dihydro-2h-isoindol-2-yl)-3-(4-nitrophenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.