5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid
TL;DR: 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid (CAS 404583-70-6) is a chemical compound with molecular formula C23H13N3O9 and molecular weight 475.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[2-(3-nitrophenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzene-1,3-dicarboxylic acid
Also Known As: 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid, 5-[[2-(3-nitrophenyl)-1,3-dioxo-isoindole-5-carbonyl]amino]benzene-1,3-dicarboxylic Acid, 5-[[2-(3-nitrophenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzene-1,3-dicarboxylic acid, 5-({[2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)benzene-1,3-dicarboxylic acid
| Molecular Formula | C23H13N3O9 |
|---|---|
| Molecular Weight | 475.07 g/mol |
| LogP | 3.0441 |
| Topological Polar Surface Area | 184.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 475.0652 |
| Heavy Atoms | 35 |
| Complexity | 1446.5588 |
Chemical Identifiers
| CAS Number | 404583-70-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC(=CC(=C4)C(=O)O)C(=O)O |
Product Overview
5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid (CAS 404583-70-6), with molecular formula C23H13N3O9 and molecular weight 475.07 g/mol. IUPAC: 5-[[2-(3-nitrophenyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid
Property Insights of 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid
The XLogP value of 3.0441 indicates that 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.22 Ų indicates high polarity, suggesting 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid has 3 hydrogen bond donor(s) and 7 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 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid?
The CAS number of 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid is 404583-70-6.
What is the molecular formula of 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid?
The molecular formula of 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid is C23H13N3O9.
What is the molecular weight of 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid?
The molecular weight of 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid is 475.07 g/mol.
Where can I buy 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid?
You can request a quote for 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-(3-nitrophenyl)-1,3-dioxoisoindoline-5-carboxamido)isophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.