4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid
TL;DR: 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid (CAS 70239-77-9) is a chemical compound with molecular formula C17H14N2O8S2 and molecular weight 438.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-aminobenzoyl)amino]-5-hydroxynaphthalene-1,7-disulfonic acid
Also Known As: EINECS 274-493-8, 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid, 1,7-Naphthalenedisulfonicacid, 4-[(3-aminobenzoyl)amino]-5-hydroxy-, 4-[(3-aminobenzoyl)amino]-5-hydroxynaphthalene-1,7-disulphonic acid, 4-(3-aminobenzamido)-5-hydroxynaphthalene-1,7-disulfonic acid
| Molecular Formula | C17H14N2O8S2 |
|---|---|
| Molecular Weight | 438.02 g/mol |
| LogP | 1.8733 |
| Topological Polar Surface Area | 184.09 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.01917 |
| Heavy Atoms | 29 |
| Complexity | 1365.6885 |
Chemical Identifiers
| CAS Number | 70239-77-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N)C(=O)NC2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)O |
Product Overview
4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid (CAS 70239-77-9), with molecular formula C17H14N2O8S2 and molecular weight 438.02 g/mol. IUPAC: 4-[(3-aminobenzoyl)amino]-5-hydroxynaphthalene-1,7-disulfonic acid.
Chemical Property Profile of 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid
Property Insights of 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid
The XLogP value of 1.8733 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid. The TPSA of 184.09 Ų indicates high polarity, suggesting 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid has 5 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 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid?
The CAS number of 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid is 70239-77-9.
What is the molecular formula of 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid?
The molecular formula of 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid is C17H14N2O8S2.
What is the molecular weight of 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid?
The molecular weight of 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid is 438.02 g/mol.
Where can I buy 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid?
You can request a quote for 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((3-Aminobenzoyl)amino)-5-hydroxynaphthalene-1,7-disulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.