CBKinase1_004069
TL;DR: CBKinase1_004069 (CAS 476484-37-4) is a chemical compound with molecular formula C24H19ClN6O2S and molecular weight 490.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1H-indazol-6-yl)acetamide
Also Known As: CBKinase1_004069, CBKinase1_016469, 2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1H-indazol-6-yl)acetamide, AB01249661-02, BRD-K78587091-001-01-6
| Molecular Formula | C24H19ClN6O2S |
|---|---|
| Molecular Weight | 490.10 g/mol |
| LogP | 5.2034 |
| Topological Polar Surface Area | 97.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 490.09787 |
| Heavy Atoms | 34 |
| Complexity | 1446.9049 |
Chemical Identifiers
| CAS Number | 476484-37-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC5=C(C=C4)C=NN5 |
Product Overview
CBKinase1_004069 (CAS 476484-37-4), with molecular formula C24H19ClN6O2S and molecular weight 490.10 g/mol. IUPAC: 2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1H-indazol-6-yl)acetamide.
Chemical Property Profile of CBKinase1_004069
Property Insights of CBKinase1_004069
The XLogP value of 5.2034 indicates that CBKinase1_004069 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.72 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004069. Following Lipinski's Rule of Five, CBKinase1_004069 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_004069?
The CAS number of CBKinase1_004069 is 476484-37-4.
What is the molecular formula of CBKinase1_004069?
The molecular formula of CBKinase1_004069 is C24H19ClN6O2S.
What is the molecular weight of CBKinase1_004069?
The molecular weight of CBKinase1_004069 is 490.10 g/mol.
Where can I buy CBKinase1_004069?
You can request a quote for CBKinase1_004069 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004069?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004069 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.