6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)
TL;DR: 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) (CAS 401462-08-6) is a chemical compound with molecular formula C22H16N2O8 and molecular weight 436.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-[(2-carboxy-4-hydroxyphenyl)carbamoyl]benzoyl]amino]-5-hydroxybenzoic acid
Also Known As: 6,6'-(isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid), 2,2'-[benzene-1,3-diylbis(carbonylimino)]bis(5-hydroxybenzoic acid), 2-[[3-[(2-carboxy-4-hydroxy-phenyl)carbamoyl]benzoyl]amino]-5-hydroxy-benzoic Acid, 2-[[3-[(2-carboxy-4-hydroxyphenyl)carbamoyl]benzoyl]amino]-5-hydroxybenzoic acid
| Molecular Formula | C22H16N2O8 |
|---|---|
| Molecular Weight | 436.09 g/mol |
| LogP | 2.9988 |
| Topological Polar Surface Area | 173.26 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 436.09067 |
| Heavy Atoms | 32 |
| Complexity | 1159.6782 |
Chemical Identifiers
| CAS Number | 401462-08-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)NC2=C(C=C(C=C2)O)C(=O)O)C(=O)NC3=C(C=C(C=C3)O)C(=O)O |
Product Overview
6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) (CAS 401462-08-6), with molecular formula C22H16N2O8 and molecular weight 436.09 g/mol. IUPAC: 2-[[3-[(2-carboxy-4-hydroxyphenyl)carbamoyl]benzoyl]amino]-5-hydroxybenzoic acid.
Chemical Property Profile of 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)
Property Insights of 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)
The XLogP value of 2.9988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid). The TPSA of 173.26 Ų indicates high polarity, suggesting 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) has 6 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 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)?
The CAS number of 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) is 401462-08-6.
What is the molecular formula of 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)?
The molecular formula of 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) is C22H16N2O8.
What is the molecular weight of 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)?
The molecular weight of 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) is 436.09 g/mol.
Where can I buy 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)?
You can request a quote for 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid)?
Yes, KEHONG BIO provides custom synthesis services for 6,6'-(Isophthaloylbis(azanediyl))bis(3-hydroxybenzoic acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.