CBKinase1_003160
TL;DR: CBKinase1_003160 (CAS 496777-10-7) is a chemical compound with molecular formula C20H20ClN3O4S and molecular weight 433.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: CBKinase1_003160, CBKinase1_015560, AF-399/41767570, BRD-K00718070-001-01-5, 1-(4-chlorophenyl)-2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
| Molecular Formula | C20H20ClN3O4S |
|---|---|
| Molecular Weight | 433.09 g/mol |
| LogP | 4.1363 |
| Topological Polar Surface Area | 75.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 433.0863 |
| Heavy Atoms | 29 |
| Complexity | 996.0609 |
Chemical Identifiers
| CAS Number | 496777-10-7 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)C3=CC(=C(C(=C3)OC)OC)OC |
Product Overview
CBKinase1_003160 (CAS 496777-10-7), with molecular formula C20H20ClN3O4S and molecular weight 433.09 g/mol. IUPAC: 1-(4-chlorophenyl)-2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone.
Chemical Property Profile of CBKinase1_003160
Property Insights of CBKinase1_003160
The XLogP value of 4.1363 indicates that CBKinase1_003160 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.47 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003160. Following Lipinski's Rule of Five, CBKinase1_003160 has 0 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_003160?
The CAS number of CBKinase1_003160 is 496777-10-7.
What is the molecular formula of CBKinase1_003160?
The molecular formula of CBKinase1_003160 is C20H20ClN3O4S.
What is the molecular weight of CBKinase1_003160?
The molecular weight of CBKinase1_003160 is 433.09 g/mol.
Where can I buy CBKinase1_003160?
You can request a quote for CBKinase1_003160 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003160?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003160 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.