RefChem:340676
TL;DR: RefChem:340676 (CAS 6659-76-3) is a chemical compound with molecular formula C18H22ClN3O4S and molecular weight 411.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(2-chloro-4-methylsulfonylphenyl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol
Also Known As: 2,2'-((4-((2-Chloro-4-(methylsulphonyl)phenyl)azo)-3-methylphenyl)imino)bisethanol, Ethanol,2,2'-[[4-[[2-chloro-4-(methylsulfonyl)phenyl]azo]-3-methylphenyl]imino]bis-(9CI), Ethanol, 2,2'-((4-((2-chloro-4-(methylsulfonyl)phenyl)azo)-3-methylphenyl)imino)bis-, Ethanol, 2,2'-[[4-[[2-chloro-4-(methylsulfonyl)phenyl]azo]-3-methylphenyl]imino]bis-, 2,2'-[[4-[[2-chloro-4- phenyl]azo]-3-methylphenyl]imino]bisethanol
| Molecular Formula | C18H22ClN3O4S |
|---|---|
| Molecular Weight | 411.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 411.10196 |
| Heavy Atoms | 27 |
| Complexity | 578.0 |
Chemical Identifiers
| CAS Number | 6659-76-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(C=C2)S(=O)(=O)C)Cl |
| InChIKey | KLMFZVQIWHSLOE-UHFFFAOYSA-N |
Product Overview
RefChem:340676 (CAS 6659-76-3), with molecular formula C18H22ClN3O4S and molecular weight 411.10 g/mol. IUPAC: 2-[4-[(2-chloro-4-methylsulfonylphenyl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol.
Chemical Property Profile of RefChem:340676
Property Insights of RefChem:340676
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:340676. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:340676. Following Lipinski's Rule of Five, RefChem:340676 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
Frequently Asked Questions
What is the CAS number of RefChem:340676?
The CAS number of RefChem:340676 is 6659-76-3.
What is the molecular formula of RefChem:340676?
The molecular formula of RefChem:340676 is C18H22ClN3O4S.
What is the molecular weight of RefChem:340676?
The molecular weight of RefChem:340676 is 411.10 g/mol.
Where can I buy RefChem:340676?
You can request a quote for RefChem:340676 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:340676?
Yes, KEHONG BIO provides custom synthesis services for RefChem:340676 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.