C22H22ClNO6S
TL;DR: C22H22ClNO6S (CAS 1009527-21-2) is a chemical compound with molecular formula C22H22ClNO6S and molecular weight 463.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-4-ethyl-2-oxochromen-7-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]butanoate
Also Known As: (6-chloro-4-ethyl-2-oxochromen-7-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]butanoate
| Molecular Formula | C22H22ClNO6S |
|---|---|
| Molecular Weight | 463.09 g/mol |
| LogP | 3.97972 |
| Topological Polar Surface Area | 102.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.08563 |
| Heavy Atoms | 31 |
| Complexity | 1281.8392 |
Chemical Identifiers
| CAS Number | 1009527-21-2 |
|---|---|
| SMILES | CCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)[C@@H](CC)NS(=O)(=O)C3=CC=C(C=C3)C |
Product Overview
C22H22ClNO6S (CAS 1009527-21-2), with molecular formula C22H22ClNO6S and molecular weight 463.09 g/mol. IUPAC: (6-chloro-4-ethyl-2-oxochromen-7-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]butanoate.
Chemical Property Profile of C22H22ClNO6S
Property Insights of C22H22ClNO6S
The XLogP value of 3.97972 indicates that C22H22ClNO6S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.68 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H22ClNO6S. Following Lipinski's Rule of Five, C22H22ClNO6S 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 C22H22ClNO6S?
The CAS number of C22H22ClNO6S is 1009527-21-2.
What is the molecular formula of C22H22ClNO6S?
The molecular formula of C22H22ClNO6S is C22H22ClNO6S.
What is the molecular weight of C22H22ClNO6S?
The molecular weight of C22H22ClNO6S is 463.09 g/mol.
Where can I buy C22H22ClNO6S?
You can request a quote for C22H22ClNO6S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H22ClNO6S?
Yes, KEHONG BIO provides custom synthesis services for C22H22ClNO6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.