2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid
TL;DR: 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid (CAS 667410-64-2) is a chemical compound with molecular formula C18H14N2O5 and molecular weight 338.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-[(2-methyl-1,3-dioxoisoindole-5-carbonyl)amino]benzoic acid
Also Known As: 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid, 2-methyl-3-[(2-methyl-1,3-dioxo-isoindole-5-carbonyl)amino]benzoic Acid, 2-methyl-3-[(2-methyl-1,3-dioxoisoindole-5-carbonyl)amino]benzoic acid, 2-methyl-3-{[(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)carbonyl]amino}benzoic acid
| Molecular Formula | C18H14N2O5 |
|---|---|
| Molecular Weight | 338.09 g/mol |
| LogP | 2.17132 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.09027 |
| Heavy Atoms | 25 |
| Complexity | 948.4778 |
Chemical Identifiers
| CAS Number | 667410-64-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C)C(=O)O |
Product Overview
2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid (CAS 667410-64-2), with molecular formula C18H14N2O5 and molecular weight 338.09 g/mol. IUPAC: 2-methyl-3-[(2-methyl-1,3-dioxoisoindole-5-carbonyl)amino]benzoic acid.
Chemical Property Profile of 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid
Property Insights of 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid
The XLogP value of 2.17132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid. Following Lipinski's Rule of Five, 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic 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 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid?
The CAS number of 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid is 667410-64-2.
What is the molecular formula of 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid?
The molecular formula of 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid is C18H14N2O5.
What is the molecular weight of 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid?
The molecular weight of 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid is 338.09 g/mol.
Where can I buy 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid?
You can request a quote for 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-3-(2-methyl-1,3-dioxoisoindoline-5-carboxamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.