CBKinase1_003164
TL;DR: CBKinase1_003164 (CAS 683793-95-5) is a chemical compound with molecular formula C22H20ClN3O4S and molecular weight 457.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-2-[[5-cyano-4-(2,3-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide
Also Known As: CBKinase1_003164, CBKinase1_015564, BRD-A37846080-001-01-1, N-(2-chlorophenyl)-2-[[5-cyano-4-(2,3-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide, N-(2-chlorophenyl)-2-{[3-cyano-4-(2,3-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
| Molecular Formula | C22H20ClN3O4S |
|---|---|
| Molecular Weight | 457.09 g/mol |
| LogP | 4.06778 |
| Topological Polar Surface Area | 100.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.0863 |
| Heavy Atoms | 31 |
| Complexity | 1080.666 |
Chemical Identifiers
| CAS Number | 683793-95-5 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC=C3Cl |
Product Overview
CBKinase1_003164 (CAS 683793-95-5), with molecular formula C22H20ClN3O4S and molecular weight 457.09 g/mol. IUPAC: N-(2-chlorophenyl)-2-[[5-cyano-4-(2,3-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_003164
Property Insights of CBKinase1_003164
The XLogP value of 4.06778 indicates that CBKinase1_003164 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.45 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003164. Following Lipinski's Rule of Five, CBKinase1_003164 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 CBKinase1_003164?
The CAS number of CBKinase1_003164 is 683793-95-5.
What is the molecular formula of CBKinase1_003164?
The molecular formula of CBKinase1_003164 is C22H20ClN3O4S.
What is the molecular weight of CBKinase1_003164?
The molecular weight of CBKinase1_003164 is 457.09 g/mol.
Where can I buy CBKinase1_003164?
You can request a quote for CBKinase1_003164 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003164?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003164 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.