CBKinase1_003852
TL;DR: CBKinase1_003852 (CAS 499124-54-8) is a chemical compound with molecular formula C24H22N4O2S and molecular weight 430.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: CBKinase1_003852, CBKinase1_016252, BRD-K06814713-001-01-9, 1-(4-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone, 1-(4-ethoxyphenyl)-2-((5-(pyridin-4-yl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)ethanone
| Molecular Formula | C24H22N4O2S |
|---|---|
| Molecular Weight | 430.15 g/mol |
| LogP | 5.01142 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.14636 |
| Heavy Atoms | 31 |
| Complexity | 1156.6758 |
Chemical Identifiers
| CAS Number | 499124-54-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)C4=CC=NC=C4 |
Product Overview
CBKinase1_003852 (CAS 499124-54-8), with molecular formula C24H22N4O2S and molecular weight 430.15 g/mol. IUPAC: 1-(4-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone.
Chemical Property Profile of CBKinase1_003852
Property Insights of CBKinase1_003852
The XLogP value of 5.01142 indicates that CBKinase1_003852 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003852. Following Lipinski's Rule of Five, CBKinase1_003852 has 0 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_003852?
The CAS number of CBKinase1_003852 is 499124-54-8.
What is the molecular formula of CBKinase1_003852?
The molecular formula of CBKinase1_003852 is C24H22N4O2S.
What is the molecular weight of CBKinase1_003852?
The molecular weight of CBKinase1_003852 is 430.15 g/mol.
Where can I buy CBKinase1_003852?
You can request a quote for CBKinase1_003852 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003852?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003852 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.