RefChem:404336
TL;DR: RefChem:404336 (CAS 606954-99-8) is a chemical compound with molecular formula C23H23N3O3S and molecular weight 421.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(4-butoxyphenyl)methylidene]-2-(4-ethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: SALOR-INT L426571-1EA, (5E)-5-(4-butoxybenzylidene)-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 5-(4-Butoxybenzylidene)-2-(4-ethoxyphenyl)thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, (5E)-5-(4-Butoxybenzylidene)-2-(4-ethoxyphenyl)(1,3)thiazolo(3,2-B)(1,2,4)triazol-6(5H)-one, (5E)-5-[(4-butoxyphenyl)methylidene]-2-(4-ethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
| Molecular Formula | C23H23N3O3S |
|---|---|
| Molecular Weight | 421.15 g/mol |
| LogP | 3.9433 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 421.14603 |
| Heavy Atoms | 30 |
| Complexity | 1227.9233 |
Chemical Identifiers
| CAS Number | 606954-99-8 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)/C=C/2\C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC)S2 |
Product Overview
RefChem:404336 (CAS 606954-99-8), with molecular formula C23H23N3O3S and molecular weight 421.15 g/mol. IUPAC: (5E)-5-[(4-butoxyphenyl)methylidene]-2-(4-ethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of RefChem:404336
Property Insights of RefChem:404336
The XLogP value of 3.9433 indicates that RefChem:404336 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.72 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:404336. Following Lipinski's Rule of Five, RefChem:404336 has 0 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 RefChem:404336?
The CAS number of RefChem:404336 is 606954-99-8.
What is the molecular formula of RefChem:404336?
The molecular formula of RefChem:404336 is C23H23N3O3S.
What is the molecular weight of RefChem:404336?
The molecular weight of RefChem:404336 is 421.15 g/mol.
Where can I buy RefChem:404336?
You can request a quote for RefChem:404336 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404336?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404336 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.