CBKinase1_003364
TL;DR: CBKinase1_003364 (CAS 499124-69-5) is a chemical compound with molecular formula C23H21N5O2S and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxyphenyl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: CBKinase1_003364, CBKinase1_015764, N-(3-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, BRD-K72794484-001-01-9, N-(3-methoxyphenyl)-2-((5-(pyridin-4-yl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamide
| Molecular Formula | C23H21N5O2S |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 4.37712 |
| Topological Polar Surface Area | 81.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.1416 |
| Heavy Atoms | 31 |
| Complexity | 1176.3134 |
Chemical Identifiers
| CAS Number | 499124-69-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)OC)C4=CC=NC=C4 |
Product Overview
CBKinase1_003364 (CAS 499124-69-5), with molecular formula C23H21N5O2S and molecular weight 431.14 g/mol. IUPAC: N-(3-methoxyphenyl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_003364
Property Insights of CBKinase1_003364
The XLogP value of 4.37712 indicates that CBKinase1_003364 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.93 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003364. Following Lipinski's Rule of Five, CBKinase1_003364 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_003364?
The CAS number of CBKinase1_003364 is 499124-69-5.
What is the molecular formula of CBKinase1_003364?
The molecular formula of CBKinase1_003364 is C23H21N5O2S.
What is the molecular weight of CBKinase1_003364?
The molecular weight of CBKinase1_003364 is 431.14 g/mol.
Where can I buy CBKinase1_003364?
You can request a quote for CBKinase1_003364 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003364?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003364 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.