RefChem:408825
TL;DR: RefChem:408825 (CAS 63134-03-2) is a chemical compound with molecular formula C22H28ClN3O3S and molecular weight 449.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-[(2-chloro-4-methylsulfonylphenyl)diazenyl]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethanol
Also Known As: Cyclohexanecarbonyl chloride,4-cyano-,trans-(9CI), 1(2H)-Quinolineethanol, 6-(2-(2-chloro-4-(methylsulfonyl)phenyl)diazenyl)-3,4-dihydro-2,2,4,7-tetramethyl-, 1(2H)-Quinolineethanol, 6-((2-chloro-4-(methylsulfonyl)phenyl)azo)-3,4-dihydro-2,2,4,7-tetramethyl-, 1(2H)-Quinolineethanol, 6-[2-[2-chloro-4-(methylsulfonyl)phenyl]diazenyl]-3,4-dihydro-2,2,4,7-tetramethyl-, 1(2H)-Quinolineethanol, 6-[[2-chloro-4-(methylsulfonyl)phenyl]azo]-3,4-dihydro-2,2,4,7-tetramethyl-
| Molecular Formula | C22H28ClN3O3S |
|---|---|
| Molecular Weight | 449.15 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.154 |
| Heavy Atoms | 30 |
| Complexity | 724.0 |
Chemical Identifiers
| CAS Number | 63134-03-2 |
|---|---|
| SMILES | CC1CC(N(C2=C1C=C(C(=C2)C)N=NC3=C(C=C(C=C3)S(=O)(=O)C)Cl)CCO)(C)C |
| InChIKey | HOOCPUZKGIXXDM-UHFFFAOYSA-N |
Product Overview
RefChem:408825 (CAS 63134-03-2), with molecular formula C22H28ClN3O3S and molecular weight 449.15 g/mol. IUPAC: 2-[6-[(2-chloro-4-methylsulfonylphenyl)diazenyl]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethanol.
Chemical Property Profile of RefChem:408825
Property Insights of RefChem:408825
The XLogP value of 4.7 indicates that RefChem:408825 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:408825. Following Lipinski's Rule of Five, RefChem:408825 has 1 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:408825?
The CAS number of RefChem:408825 is 63134-03-2.
What is the molecular formula of RefChem:408825?
The molecular formula of RefChem:408825 is C22H28ClN3O3S.
What is the molecular weight of RefChem:408825?
The molecular weight of RefChem:408825 is 449.15 g/mol.
Where can I buy RefChem:408825?
You can request a quote for RefChem:408825 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:408825?
Yes, KEHONG BIO provides custom synthesis services for RefChem:408825 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.