CBKinase1_008319
TL;DR: CBKinase1_008319 (CAS 578005-08-0) is a chemical compound with molecular formula C16H15BrN4O2S and molecular weight 406.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromo-4-methylphenyl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: CBKinase1_008319, CBKinase1_020719, BRD-K30862181-001-01-1, N-(2-bromo-4-methylphenyl)-2-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-bromo-4-methylphenyl)-2-((5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)acetamide
| Molecular Formula | C16H15BrN4O2S |
|---|---|
| Molecular Weight | 406.01 g/mol |
| LogP | 3.87682 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.00992 |
| Heavy Atoms | 24 |
| Complexity | 861.097 |
Chemical Identifiers
| CAS Number | 578005-08-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=CO3)Br |
Product Overview
CBKinase1_008319 (CAS 578005-08-0), with molecular formula C16H15BrN4O2S and molecular weight 406.01 g/mol. IUPAC: N-(2-bromo-4-methylphenyl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_008319
Property Insights of CBKinase1_008319
The XLogP value of 3.87682 indicates that CBKinase1_008319 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_008319. Following Lipinski's Rule of Five, CBKinase1_008319 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_008319?
The CAS number of CBKinase1_008319 is 578005-08-0.
What is the molecular formula of CBKinase1_008319?
The molecular formula of CBKinase1_008319 is C16H15BrN4O2S.
What is the molecular weight of CBKinase1_008319?
The molecular weight of CBKinase1_008319 is 406.01 g/mol.
Where can I buy CBKinase1_008319?
You can request a quote for CBKinase1_008319 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008319?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008319 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.