CBKinase1_007667
TL;DR: CBKinase1_007667 (CAS 557072-72-7) is a chemical compound with molecular formula C18H20N4OS2 and molecular weight 372.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dimethylphenyl)-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_007667, CBKinase1_020067, BAS 04040428, N-(2,3-DIMETHYLPHENYL)-2-{[4-ETHYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE, BRD-K28296736-001-01-6
| Molecular Formula | C18H20N4OS2 |
|---|---|
| Molecular Weight | 372.11 g/mol |
| LogP | 4.37414 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.10785 |
| Heavy Atoms | 25 |
| Complexity | 871.3409 |
Chemical Identifiers
| CAS Number | 557072-72-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2C)C)C3=CC=CS3 |
Product Overview
CBKinase1_007667 (CAS 557072-72-7), with molecular formula C18H20N4OS2 and molecular weight 372.11 g/mol. IUPAC: N-(2,3-dimethylphenyl)-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_007667
Property Insights of CBKinase1_007667
The XLogP value of 4.37414 indicates that CBKinase1_007667 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, CBKinase1_007667 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_007667 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_007667?
The CAS number of CBKinase1_007667 is 557072-72-7.
What is the molecular formula of CBKinase1_007667?
The molecular formula of CBKinase1_007667 is C18H20N4OS2.
What is the molecular weight of CBKinase1_007667?
The molecular weight of CBKinase1_007667 is 372.11 g/mol.
Where can I buy CBKinase1_007667?
You can request a quote for CBKinase1_007667 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007667?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007667 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.