CBKinase1_002687
TL;DR: CBKinase1_002687 (CAS 693254-46-5) is a chemical compound with molecular formula C27H20FN3O3S and molecular weight 485.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-benzoylphenyl)-2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide
Also Known As: CBKinase1_002687, CBKinase1_015087, F1461-0561, BRD-A62948656-001-01-7, N-(2-benzoylphenyl)-2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
| Molecular Formula | C27H20FN3O3S |
|---|---|
| Molecular Weight | 485.12 g/mol |
| LogP | 4.76728 |
| Topological Polar Surface Area | 99.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 485.12094 |
| Heavy Atoms | 35 |
| Complexity | 1365.3394 |
Chemical Identifiers
| CAS Number | 693254-46-5 |
|---|---|
| SMILES | C1C(C(=C(NC1=O)SCC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C#N)C4=CC=CC=C4F |
Product Overview
CBKinase1_002687 (CAS 693254-46-5), with molecular formula C27H20FN3O3S and molecular weight 485.12 g/mol. IUPAC: N-(2-benzoylphenyl)-2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_002687
Property Insights of CBKinase1_002687
The XLogP value of 4.76728 indicates that CBKinase1_002687 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.06 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002687. Following Lipinski's Rule of Five, CBKinase1_002687 has 2 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_002687?
The CAS number of CBKinase1_002687 is 693254-46-5.
What is the molecular formula of CBKinase1_002687?
The molecular formula of CBKinase1_002687 is C27H20FN3O3S.
What is the molecular weight of CBKinase1_002687?
The molecular weight of CBKinase1_002687 is 485.12 g/mol.
Where can I buy CBKinase1_002687?
You can request a quote for CBKinase1_002687 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002687?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002687 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.