3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid
TL;DR: 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid (CAS 701260-92-6) is a chemical compound with molecular formula C24H18N2O5 and molecular weight 414.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]-2-methylbenzoic acid
Also Known As: 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid, 3-[(2-benzyl-1,3-dioxo-isoindole-5-carbonyl)amino]-2-methyl-benzoic Acid, 3-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]-2-methylbenzoic acid, 3-{[(2-benzyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)carbonyl]amino}-2-methylbenzoic acid
| Molecular Formula | C24H18N2O5 |
|---|---|
| Molecular Weight | 414.12 g/mol |
| LogP | 3.74172 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.12158 |
| Heavy Atoms | 31 |
| Complexity | 1233.972 |
Chemical Identifiers
| CAS Number | 701260-92-6 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)C(=O)O |
Product Overview
3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid (CAS 701260-92-6), with molecular formula C24H18N2O5 and molecular weight 414.12 g/mol. IUPAC: 3-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]-2-methylbenzoic acid.
Chemical Property Profile of 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid
Property Insights of 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid
The XLogP value of 3.74172 indicates that 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic 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 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid. Following Lipinski's Rule of Five, 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic 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 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid?
The CAS number of 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid is 701260-92-6.
What is the molecular formula of 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid?
The molecular formula of 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid is C24H18N2O5.
What is the molecular weight of 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid?
The molecular weight of 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid is 414.12 g/mol.
Where can I buy 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid?
You can request a quote for 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-benzyl-1,3-dioxoisoindoline-5-carboxamido)-2-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.