N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline
TL;DR: N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline (CAS 61776-90-7) is a chemical compound with molecular formula C18H19N3O4 and molecular weight 341.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(diethylamino)phenyl]diazenyl]phthalic acid
Also Known As: N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline, 4-(4-diethylaminophenyl)diazenylphthalic Acid, 4-[[4-(diethylamino)phenyl]diazenyl]phthalic acid, 4-{[4-(diethylamino)phenyl]diazenyl}benzene-1,2-dicarboxylic acid, 1,2-Benzenedicarboxylic acid, 4-[2-[4-(diethylamino)phenyl]diazenyl]-
| Molecular Formula | C18H19N3O4 |
|---|---|
| Molecular Weight | 341.14 g/mol |
| LogP | 4.3446 |
| Topological Polar Surface Area | 102.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 341.13754 |
| Heavy Atoms | 25 |
| Complexity | 796.4685 |
Chemical Identifiers
| CAS Number | 61776-90-7 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)C(=O)O)C(=O)O |
Product Overview
N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline (CAS 61776-90-7), with molecular formula C18H19N3O4 and molecular weight 341.14 g/mol. IUPAC: 4-[[4-(diethylamino)phenyl]diazenyl]phthalic acid.
Chemical Property Profile of N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline
Property Insights of N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline
The XLogP value of 4.3446 indicates that N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.56 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline. Following Lipinski's Rule of Five, N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline has 2 hydrogen bond donor(s) and 5 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 N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline?
The CAS number of N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline is 61776-90-7.
What is the molecular formula of N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline?
The molecular formula of N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline is C18H19N3O4.
What is the molecular weight of N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline?
The molecular weight of N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline is 341.14 g/mol.
Where can I buy N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline?
You can request a quote for N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-4(3,4-dicarboxyphenylazo)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.