CBKinase1_002454
TL;DR: CBKinase1_002454 (CAS 634162-04-2) is a chemical compound with molecular formula C20H22N2O3S and molecular weight 370.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-ethoxyphenoxy)acetamide
Also Known As: CBKinase1_002454, CBKinase1_014854, AS-871/41743730, BRD-A08080028-001-01-7, N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-ethoxyphenoxy)acetamide
| Molecular Formula | C20H22N2O3S |
|---|---|
| Molecular Weight | 370.14 g/mol |
| LogP | 4.16078 |
| Topological Polar Surface Area | 71.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.1351 |
| Heavy Atoms | 26 |
| Complexity | 838.0672 |
Chemical Identifiers
| CAS Number | 634162-04-2 |
|---|---|
| SMILES | CCOC1=CC=CC=C1OCC(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N |
Product Overview
CBKinase1_002454 (CAS 634162-04-2), with molecular formula C20H22N2O3S and molecular weight 370.14 g/mol. IUPAC: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-ethoxyphenoxy)acetamide.
Chemical Property Profile of CBKinase1_002454
Property Insights of CBKinase1_002454
The XLogP value of 4.16078 indicates that CBKinase1_002454 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.35 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002454. Following Lipinski's Rule of Five, CBKinase1_002454 has 1 hydrogen bond donor(s) and 5 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_002454?
The CAS number of CBKinase1_002454 is 634162-04-2.
What is the molecular formula of CBKinase1_002454?
The molecular formula of CBKinase1_002454 is C20H22N2O3S.
What is the molecular weight of CBKinase1_002454?
The molecular weight of CBKinase1_002454 is 370.14 g/mol.
Where can I buy CBKinase1_002454?
You can request a quote for CBKinase1_002454 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002454?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002454 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.