BAS 02563237
TL;DR: BAS 02563237 (CAS 333411-91-9) is a chemical compound with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: BAS 02563237, ethyl 4-[({[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate, ethyl 4-[[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate, ethyl 4-(2-((4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate, ethyl 4-{2-[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-ylthio]acetylamino}ben zoate
| Molecular Formula | C22H24N4O4S |
|---|---|
| Molecular Weight | 440.15 g/mol |
| LogP | 3.8811 |
| Topological Polar Surface Area | 95.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 440.15182 |
| Heavy Atoms | 31 |
| Complexity | 1032.6694 |
Chemical Identifiers
| CAS Number | 333411-91-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OCC)C3=CC=C(C=C3)OC |
Product Overview
BAS 02563237 (CAS 333411-91-9), with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol. IUPAC: ethyl 4-[[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of BAS 02563237
Property Insights of BAS 02563237
The XLogP value of 3.8811 indicates that BAS 02563237 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02563237. Following Lipinski's Rule of Five, BAS 02563237 has 1 hydrogen bond donor(s) and 7 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 BAS 02563237?
The CAS number of BAS 02563237 is 333411-91-9.
What is the molecular formula of BAS 02563237?
The molecular formula of BAS 02563237 is C22H24N4O4S.
What is the molecular weight of BAS 02563237?
The molecular weight of BAS 02563237 is 440.15 g/mol.
Where can I buy BAS 02563237?
You can request a quote for BAS 02563237 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02563237?
Yes, KEHONG BIO provides custom synthesis services for BAS 02563237 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.