![2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid structure](/static/products/640/640280-74-6.png)
2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid
TL;DR: 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid (CAS 640280-74-6) is a chemical compound with molecular formula C27H22F3N3O5 and molecular weight 525.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2-carboxyanilino)-5-(trifluoromethyl)anilino]-5-[(furan-3-ylmethylamino)methyl]benzoic acid
Also Known As: 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid, Benzoicacid,2-[[2-[ amino]-5- phenyl]amino]-5-[[ amino]methyl]-, benzoicacid,2-[[2-[amino]-5- phenyl]amino]-5-[[amino]methyl]-
| Molecular Formula | C27H22F3N3O5 |
|---|---|
| Molecular Weight | 525.15 g/mol |
| LogP | 6.4718 |
| Topological Polar Surface Area | 123.83 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 525.1512 |
| Heavy Atoms | 38 |
| Complexity | 1452.8462 |
Chemical Identifiers
| CAS Number | 640280-74-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=C(C=C(C=C2)C(F)(F)F)NC3=C(C=C(C=C3)CNCC4=COC=C4)C(=O)O |
Product Overview
2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid (CAS 640280-74-6), with molecular formula C27H22F3N3O5 and molecular weight 525.15 g/mol. IUPAC: 2-[2-(2-carboxyanilino)-5-(trifluoromethyl)anilino]-5-[(furan-3-ylmethylamino)methyl]benzoic acid.
Chemical Property Profile of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid
Property Insights of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid
The XLogP value of 6.4718 indicates that 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid. Following Lipinski's Rule of Five, 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid?
The CAS number of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid is 640280-74-6.
What is the molecular formula of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid?
The molecular formula of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid is C27H22F3N3O5.
What is the molecular weight of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid?
The molecular weight of 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid is 525.15 g/mol.
Where can I buy 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid?
You can request a quote for 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}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-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({2-[(2-Carboxyphenyl)amino]-5-(trifluoromethyl)phenyl}amino)-5-{[(3-furylmethyl)amino]methyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.