CBKinase1_004833
TL;DR: CBKinase1_004833 (CAS 671200-72-9) is a chemical compound with molecular formula C20H13ClN6OS2 and molecular weight 452.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)acetamide
Also Known As: CBKinase1_004833, CBKinase1_017233, VU0618210-1, F3394-0731, AQ-750/42050702
| Molecular Formula | C20H13ClN6OS2 |
|---|---|
| Molecular Weight | 452.03 g/mol |
| LogP | 4.7852 |
| Topological Polar Surface Area | 85.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 452.02808 |
| Heavy Atoms | 30 |
| Complexity | 1365.0306 |
Chemical Identifiers
| CAS Number | 671200-72-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=NN=C(N32)SCC(=O)NC4=NSC(=N4)C5=CC=C(C=C5)Cl |
Product Overview
CBKinase1_004833 (CAS 671200-72-9), with molecular formula C20H13ClN6OS2 and molecular weight 452.03 g/mol. IUPAC: N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)acetamide.
Chemical Property Profile of CBKinase1_004833
Property Insights of CBKinase1_004833
The XLogP value of 4.7852 indicates that CBKinase1_004833 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.07 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004833. Following Lipinski's Rule of Five, CBKinase1_004833 has 1 hydrogen bond donor(s) and 7 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_004833?
The CAS number of CBKinase1_004833 is 671200-72-9.
What is the molecular formula of CBKinase1_004833?
The molecular formula of CBKinase1_004833 is C20H13ClN6OS2.
What is the molecular weight of CBKinase1_004833?
The molecular weight of CBKinase1_004833 is 452.03 g/mol.
Where can I buy CBKinase1_004833?
You can request a quote for CBKinase1_004833 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004833?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004833 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.