2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid
TL;DR: 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid (CAS 22531-46-0) is a chemical compound with molecular formula C18H20N2O9S and molecular weight 440.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[carboxymethyl-[2-[carboxymethyl-(4-sulfonaphthalen-1-yl)amino]ethyl]amino]acetic acid
Also Known As: 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid, [{2-[bis(carboxymethyl)amino]ethyl}(4-sulfo-1-naphthyl)amino]acetic acid, N-{2-[bis(carboxymethyl)amino]ethyl}-N-(4-sulfonaphthalen-1-yl)glycine, ((2-(BIS-CARBOXYMETHYL-AMINO)-ET)-(4-SULFO-NAPHTHALEN-1-YL)-AMINO)-ACETIC ACID, 2-((carboxymethyl){2-[(carboxymethyl)(4-sulfonaphthyl)amino]ethyl}amino)acetic acid
| Molecular Formula | C18H20N2O9S |
|---|---|
| Molecular Weight | 440.09 g/mol |
| LogP | 0.4487 |
| Topological Polar Surface Area | 172.75 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 440.08896 |
| Heavy Atoms | 30 |
| Complexity | 1052.5116 |
Chemical Identifiers
| CAS Number | 22531-46-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O |
Product Overview
2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid (CAS 22531-46-0), with molecular formula C18H20N2O9S and molecular weight 440.09 g/mol. IUPAC: 2-[carboxymethyl-[2-[carboxymethyl-(4-sulfonaphthalen-1-yl)amino]ethyl]amino]acetic acid.
Chemical Property Profile of 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid
Property Insights of 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid
The XLogP value of 0.4487 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid. The TPSA of 172.75 Ų indicates high polarity, suggesting 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic 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 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid?
The CAS number of 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid is 22531-46-0.
What is the molecular formula of 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid?
The molecular formula of 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid is C18H20N2O9S.
What is the molecular weight of 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid?
The molecular weight of 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid is 440.09 g/mol.
Where can I buy 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid?
You can request a quote for 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic 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-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-((2-((Carboxymethyl)(4-sulfonaphthalen-1-yl)amino)ethyl)azanediyl)diacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.