1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid
TL;DR: 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid (CAS 413582-64-6) is a chemical compound with molecular formula C23H16N2O5 and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(4-methylphenyl)carbamoyl]phenyl]-1,3-dioxoisoindole-5-carboxylic acid
Also Known As: 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid, 2-(4-{[(4-methylphenyl)amino]carbonyl}phenyl)-1,3-dioxo-5-isoindolinecarboxylic acid, 2-[4-[(4-methylphenyl)carbamoyl]phenyl]-1,3-dioxoisoindole-5-carboxylic acid, 2-{4-[(4-methylphenyl)carbamoyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
| Molecular Formula | C23H16N2O5 |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 3.74612 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.10593 |
| Heavy Atoms | 30 |
| Complexity | 1197.2681 |
Chemical Identifiers
| CAS Number | 413582-64-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O |
Product Overview
1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid (CAS 413582-64-6), with molecular formula C23H16N2O5 and molecular weight 400.11 g/mol. IUPAC: 2-[4-[(4-methylphenyl)carbamoyl]phenyl]-1,3-dioxoisoindole-5-carboxylic acid.
Chemical Property Profile of 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid
Property Insights of 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid
The XLogP value of 3.74612 indicates that 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid. Following Lipinski's Rule of Five, 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid has 2 hydrogen bond donor(s) and 4 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 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid?
The CAS number of 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid is 413582-64-6.
What is the molecular formula of 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid?
The molecular formula of 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid is C23H16N2O5.
What is the molecular weight of 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid?
The molecular weight of 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid is 400.11 g/mol.
Where can I buy 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid?
You can request a quote for 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dioxo-2-(4-(p-tolylcarbamoyl)phenyl)isoindoline-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.