CBKinase1_006024
TL;DR: CBKinase1_006024 (CAS 557072-86-3) is a chemical compound with molecular formula C17H18N4O2S2 and molecular weight 374.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_006024, CBKinase1_018424, BAS 04040589, BRD-K81535142-001-01-9, N-(4-ethoxyphenyl)-2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C17H18N4O2S2 |
|---|---|
| Molecular Weight | 374.09 g/mol |
| LogP | 3.6731 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 374.08713 |
| Heavy Atoms | 25 |
| Complexity | 828.9672 |
Chemical Identifiers
| CAS Number | 557072-86-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=CS3 |
Product Overview
CBKinase1_006024 (CAS 557072-86-3), with molecular formula C17H18N4O2S2 and molecular weight 374.09 g/mol. IUPAC: N-(4-ethoxyphenyl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_006024
Property Insights of CBKinase1_006024
The XLogP value of 3.6731 indicates that CBKinase1_006024 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006024. Following Lipinski's Rule of Five, CBKinase1_006024 has 1 hydrogen bond donor(s) and 6 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_006024?
The CAS number of CBKinase1_006024 is 557072-86-3.
What is the molecular formula of CBKinase1_006024?
The molecular formula of CBKinase1_006024 is C17H18N4O2S2.
What is the molecular weight of CBKinase1_006024?
The molecular weight of CBKinase1_006024 is 374.09 g/mol.
Where can I buy CBKinase1_006024?
You can request a quote for CBKinase1_006024 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006024?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006024 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.