CBKinase1_004084
TL;DR: CBKinase1_004084 (CAS 665018-39-3) is a chemical compound with molecular formula C17H14BrN3O2S2 and molecular weight 434.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methylsulfanylphenyl)acetamide
Also Known As: CBKinase1_004084, CBKinase1_016484, AN-698/42116248, BRD-K58063868-001-01-3, 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methylsulfanylphenyl)acetamide
| Molecular Formula | C17H14BrN3O2S2 |
|---|---|
| Molecular Weight | 434.97 g/mol |
| LogP | 4.9518 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.97107 |
| Heavy Atoms | 25 |
| Complexity | 868.33936 |
Chemical Identifiers
| CAS Number | 665018-39-3 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)Br |
Product Overview
CBKinase1_004084 (CAS 665018-39-3), with molecular formula C17H14BrN3O2S2 and molecular weight 434.97 g/mol. IUPAC: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methylsulfanylphenyl)acetamide.
Chemical Property Profile of CBKinase1_004084
Property Insights of CBKinase1_004084
The XLogP value of 4.9518 indicates that CBKinase1_004084 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004084. Following Lipinski's Rule of Five, CBKinase1_004084 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 CBKinase1_004084?
The CAS number of CBKinase1_004084 is 665018-39-3.
What is the molecular formula of CBKinase1_004084?
The molecular formula of CBKinase1_004084 is C17H14BrN3O2S2.
What is the molecular weight of CBKinase1_004084?
The molecular weight of CBKinase1_004084 is 434.97 g/mol.
Where can I buy CBKinase1_004084?
You can request a quote for CBKinase1_004084 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004084?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004084 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.