RefChem:566220
TL;DR: RefChem:566220 (CAS 58498-34-3) is a chemical compound with molecular formula C18H19ClN4O2 and molecular weight 358.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-[bis(2-hydroxyethyl)amino]-2-methylphenyl]diazenyl]-2-chlorobenzonitrile
Also Known As: Benzonitrile, 4-[[4-[bis(2-hydroxyethyl)amino]-2-methylphenyl]azo]-2-chloro-, 4-((4-(Bis(2-hydroxyethyl)amino)-o-tolyl)azo)-2-chlorobenzonitrile, Benzonitrile, 4-((4-(bis(2-hydroxyethyl)amino)-2-methylphenyl)azo)-2-chloro-, N,N-Bis(2-hydroxyethyl)-3-methyl-4-((4-cyano-3-chlorophenyl)azo)benzeneamine, N,N-Bis(2-hydroxyethyl)-4-((3-chloro-4-cyanophenyl)azo)-3-methylbenzeneamine
| Molecular Formula | C18H19ClN4O2 |
|---|---|
| Molecular Weight | 358.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.11966 |
| Heavy Atoms | 25 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 58498-34-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=CC(=C(C=C2)C#N)Cl |
| InChIKey | AZLVLRPFHNHJOR-UHFFFAOYSA-N |
Product Overview
RefChem:566220 (CAS 58498-34-3), with molecular formula C18H19ClN4O2 and molecular weight 358.12 g/mol. IUPAC: 4-[[4-[bis(2-hydroxyethyl)amino]-2-methylphenyl]diazenyl]-2-chlorobenzonitrile.
Chemical Property Profile of RefChem:566220
Property Insights of RefChem:566220
The XLogP value of 3.2 indicates that RefChem:566220 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:566220. Following Lipinski's Rule of Five, RefChem:566220 has 2 hydrogen bond donor(s) and 6 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 RefChem:566220?
The CAS number of RefChem:566220 is 58498-34-3.
What is the molecular formula of RefChem:566220?
The molecular formula of RefChem:566220 is C18H19ClN4O2.
What is the molecular weight of RefChem:566220?
The molecular weight of RefChem:566220 is 358.12 g/mol.
Where can I buy RefChem:566220?
You can request a quote for RefChem:566220 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:566220?
Yes, KEHONG BIO provides custom synthesis services for RefChem:566220 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.