2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid
TL;DR: 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid (CAS 518022-76-9) is a chemical compound with molecular formula C25H20N2O7 and molecular weight 460.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]-4,5-dimethoxybenzoic acid
Also Known As: 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid, 2-[(2-benzyl-1,3-dioxo-isoindole-5-carbonyl)amino]-4,5-dimethoxy-benzoic Acid, 2-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]-4,5-dimethoxybenzoic acid, 2-{[(2-benzyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)carbonyl]amino}-4,5-dimethoxybenzoic acid
| Molecular Formula | C25H20N2O7 |
|---|---|
| Molecular Weight | 460.13 g/mol |
| LogP | 3.4505 |
| Topological Polar Surface Area | 122.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.12704 |
| Heavy Atoms | 34 |
| Complexity | 1318.3395 |
Chemical Identifiers
| CAS Number | 518022-76-9 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)OC |
Product Overview
2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid (CAS 518022-76-9), with molecular formula C25H20N2O7 and molecular weight 460.13 g/mol. IUPAC: 2-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]-4,5-dimethoxybenzoic acid.
Chemical Property Profile of 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid
Property Insights of 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid
The XLogP value of 3.4505 indicates that 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid. Following Lipinski's Rule of Five, 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid has 2 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-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid?
The CAS number of 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid is 518022-76-9.
What is the molecular formula of 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid?
The molecular formula of 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid is C25H20N2O7.
What is the molecular weight of 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid?
The molecular weight of 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid is 460.13 g/mol.
Where can I buy 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid?
You can request a quote for 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-4,5-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.