CBKinase1_006225
TL;DR: CBKinase1_006225 (CAS 701971-24-6) is a chemical compound with molecular formula C15H12BrClN4O2S and molecular weight 425.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromo-3-chlorophenyl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: CBKinase1_006225, CBKinase1_018625, BRD-K58671503-001-01-4, N-(4-bromo-3-chlorophenyl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(4-bromo-3-chlorophenyl)-2-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C15H12BrClN4O2S |
|---|---|
| Molecular Weight | 425.96 g/mol |
| LogP | 4.2218 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.9553 |
| Heavy Atoms | 24 |
| Complexity | 866.49365 |
Chemical Identifiers
| CAS Number | 701971-24-6 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Br)Cl)C3=CC=CO3 |
Product Overview
CBKinase1_006225 (CAS 701971-24-6), with molecular formula C15H12BrClN4O2S and molecular weight 425.96 g/mol. IUPAC: N-(4-bromo-3-chlorophenyl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_006225
Property Insights of CBKinase1_006225
The XLogP value of 4.2218 indicates that CBKinase1_006225 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.95 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006225. Following Lipinski's Rule of Five, CBKinase1_006225 has 1 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_006225?
The CAS number of CBKinase1_006225 is 701971-24-6.
What is the molecular formula of CBKinase1_006225?
The molecular formula of CBKinase1_006225 is C15H12BrClN4O2S.
What is the molecular weight of CBKinase1_006225?
The molecular weight of CBKinase1_006225 is 425.96 g/mol.
Where can I buy CBKinase1_006225?
You can request a quote for CBKinase1_006225 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006225?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006225 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.