4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid
TL;DR: 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid (CAS 57308-14-2) is a chemical compound with molecular formula C21H16N2O7S2 and molecular weight 472.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-sulfonaphthalen-1-yl)carbamoylamino]naphthalene-1-sulfonic acid
Also Known As: 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid, 4,4'-Ureylen-bis-naphthalin-1-sulfonsaeure, 4,4'-ureylene-bis-naphthalene-1-sulfonic acid, 4-{[(4-sulfonaphthalen-1-yl)carbamoyl]amino}naphthalene-1-sulfonic acid, 4-{[N-(4-Sulfonaphthyl)carbamoyl]amino}naphthalenesulfonic acid
| Molecular Formula | C21H16N2O7S2 |
|---|---|
| Molecular Weight | 472.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.0399 |
| Heavy Atoms | 32 |
| Complexity | 824.0 |
Chemical Identifiers
| CAS Number | 57308-14-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NC(=O)NC3=CC=C(C4=CC=CC=C43)S(=O)(=O)O |
| InChIKey | SVARQRVYLMOZHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid (CAS 57308-14-2), with molecular formula C21H16N2O7S2 and molecular weight 472.04 g/mol. IUPAC: 4-[(4-sulfonaphthalen-1-yl)carbamoylamino]naphthalene-1-sulfonic acid.
Chemical Property Profile of 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid
Property Insights of 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid. The TPSA of 167.0 Ų indicates high polarity, suggesting 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid has 4 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-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid?
The CAS number of 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid is 57308-14-2.
What is the molecular formula of 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid?
The molecular formula of 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid is C21H16N2O7S2.
What is the molecular weight of 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid?
The molecular weight of 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid is 472.04 g/mol.
Where can I buy 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid?
You can request a quote for 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((N-(4-Sulfonaphthyl)carbamoyl)amino)naphthalenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.