RefChem:571505
TL;DR: RefChem:571505 (CAS 62163-33-1) is a chemical compound with molecular formula C21H22ClN5O3 and molecular weight 427.1411 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-[(5-chloro-2-cyanophenyl)diazenyl]-5-(diethylamino)anilino]-4-oxobutanoic acid
Also Known As: 4-[[2-[ azo]-5- phenyl]amino]-4-oxobutyricacid, Butanoic acid, 4-[[2-[(5-chloro-2-cyanophenyl)azo]-5-(diethylamino)phenyl]amino]-4-oxo-, 4-[[2-[(5-Chloro-2-cyanophenyl)azo]-5-(diethylamino)phenyl]amino]-4-oxobutyric acid, Butanoic acid, 4-((2-((5-chloro-2-cyanophenyl)azo)-5-(diethylamino)phenyl)amino)-4-oxo-, Butanoic acid, 4-((2-(2-(5-chloro-2-cyanophenyl)diazenyl)-5-(diethylamino)phenyl)amino)-4-oxo-
Technical Specifications
| Molecular Formula | C21H22ClN5O3 |
| Molecular Weight | 427.1411 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 427.1411 Da |
| Heavy Atoms | 30 |
| Complexity | 660.0 |
| SMILES | CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=CC(=C2)Cl)C#N)NC(=O)CCC(=O)O |
| InChIKey | SSVJBYGRIFCYNI-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:571505
Property Insights of RefChem:571505
The XLogP value of 3.5 indicates that RefChem:571505 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:571505. Following Lipinski's Rule of Five, RefChem:571505 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:571505?
The CAS number of RefChem:571505 is 62163-33-1.
What is the molecular formula of RefChem:571505?
The molecular formula of RefChem:571505 is C21H22ClN5O3.
What is the molecular weight of RefChem:571505?
The molecular weight of RefChem:571505 is 427.1411 g/mol.
Where can I buy RefChem:571505?
You can request a quote for RefChem:571505 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:571505?
Yes, CoreyChem provides custom synthesis services for RefChem:571505 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.