CBKinase1_008534
TL;DR: CBKinase1_008534 (CAS 488121-37-5) is a chemical compound with molecular formula C22H16F3N3O2S and molecular weight 443.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: CBKinase1_008534, CBKinase1_020934, AM-807/13616453, 2-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide, 2-{[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C22H16F3N3O2S |
|---|---|
| Molecular Weight | 443.09 g/mol |
| LogP | 5.37848 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 443.09152 |
| Heavy Atoms | 31 |
| Complexity | 1126.0804 |
Chemical Identifiers
| CAS Number | 488121-37-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
CBKinase1_008534 (CAS 488121-37-5), with molecular formula C22H16F3N3O2S and molecular weight 443.09 g/mol. IUPAC: 2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of CBKinase1_008534
Property Insights of CBKinase1_008534
The XLogP value of 5.37848 indicates that CBKinase1_008534 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008534. Following Lipinski's Rule of Five, CBKinase1_008534 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_008534?
The CAS number of CBKinase1_008534 is 488121-37-5.
What is the molecular formula of CBKinase1_008534?
The molecular formula of CBKinase1_008534 is C22H16F3N3O2S.
What is the molecular weight of CBKinase1_008534?
The molecular weight of CBKinase1_008534 is 443.09 g/mol.
Where can I buy CBKinase1_008534?
You can request a quote for CBKinase1_008534 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008534?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.