BAS 02223456
TL;DR: BAS 02223456 (CAS 333322-66-0) is a chemical compound with molecular formula C26H26N4O3S and molecular weight 474.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 02223456, N-(4-Ethoxyphenyl)-2-((5-(phenoxymethyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(4-ethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(4-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(4-Ethoxy-phenyl)-2-(5-phenoxymethyl-4-p-tolyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide
| Molecular Formula | C26H26N4O3S |
|---|---|
| Molecular Weight | 474.17 g/mol |
| LogP | 5.28422 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 474.17258 |
| Heavy Atoms | 34 |
| Complexity | 1209.2965 |
Chemical Identifiers
| CAS Number | 333322-66-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)COC4=CC=CC=C4 |
Product Overview
BAS 02223456 (CAS 333322-66-0), with molecular formula C26H26N4O3S and molecular weight 474.17 g/mol. IUPAC: N-(4-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 02223456
Property Insights of BAS 02223456
The XLogP value of 5.28422 indicates that BAS 02223456 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02223456. Following Lipinski's Rule of Five, BAS 02223456 has 1 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 BAS 02223456?
The CAS number of BAS 02223456 is 333322-66-0.
What is the molecular formula of BAS 02223456?
The molecular formula of BAS 02223456 is C26H26N4O3S.
What is the molecular weight of BAS 02223456?
The molecular weight of BAS 02223456 is 474.17 g/mol.
Where can I buy BAS 02223456?
You can request a quote for BAS 02223456 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02223456?
Yes, KEHONG BIO provides custom synthesis services for BAS 02223456 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.