RefChem:404337
TL;DR: RefChem:404337 (CAS 606950-93-0) is a chemical compound with molecular formula C21H19N3O3S and molecular weight 393.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(4-ethoxy-3-methoxyphenyl)methylidene]-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: (5E)-5-(4-ethoxy-3-methoxybenzylidene)-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 5-(4-Ethoxy-3-methoxybenzylidene)-2-(p-tolyl)thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, (5E)-5-(4-ETHOXY-3-METHOXYBENZYLIDENE)-2-(4-METHYLPHENYL)(1,3)THIAZOLO(3,2-B)(1,2,4)TRIAZOL-6(5H)-ONE, (5E)-5-[(4-ethoxy-3-methoxyphenyl)methylidene]-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one, 645-558-1
| Molecular Formula | C21H19N3O3S |
|---|---|
| Molecular Weight | 393.11 g/mol |
| LogP | 3.08142 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.11472 |
| Heavy Atoms | 28 |
| Complexity | 1242.621 |
Chemical Identifiers
| CAS Number | 606950-93-0 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=C/2\C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)C)S2)OC |
Product Overview
RefChem:404337 (CAS 606950-93-0), with molecular formula C21H19N3O3S and molecular weight 393.11 g/mol. IUPAC: (5E)-5-[(4-ethoxy-3-methoxyphenyl)methylidene]-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of RefChem:404337
Property Insights of RefChem:404337
The XLogP value of 3.08142 indicates that RefChem:404337 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:404337. Following Lipinski's Rule of Five, RefChem:404337 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:404337?
The CAS number of RefChem:404337 is 606950-93-0.
What is the molecular formula of RefChem:404337?
The molecular formula of RefChem:404337 is C21H19N3O3S.
What is the molecular weight of RefChem:404337?
The molecular weight of RefChem:404337 is 393.11 g/mol.
Where can I buy RefChem:404337?
You can request a quote for RefChem:404337 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404337?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404337 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.