RefChem:404237
TL;DR: RefChem:404237 (CAS 606953-02-0) is a chemical compound with molecular formula C23H19N3O5S and molecular weight 449.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-2-(3-methyl-1-benzofuran-2-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: (5E)-2-(3-methyl-1-benzofuran-2-yl)-5-(3,4,5-trimethoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 2-(3-Methylbenzofuran-2-yl)-5-(3,4,5-trimethoxybenzylidene)thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, (5E)-2-(3-METHYL-1-BENZOFURAN-2-YL)-5-(3,4,5-TRIMETHOXYBENZYLIDENE)(1,3)THIAZOLO(3,2-B)(1,2,4)TRIAZOL-6(5H)-ONE, (5E)-2-(3-methyl-1-benzofuran-2-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one, 645-544-5
| Molecular Formula | C23H19N3O5S |
|---|---|
| Molecular Weight | 449.10 g/mol |
| LogP | 3.44612 |
| Topological Polar Surface Area | 88.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.10455 |
| Heavy Atoms | 32 |
| Complexity | 1555.7546 |
Chemical Identifiers
| CAS Number | 606953-02-0 |
|---|---|
| SMILES | CC1=C(OC2=CC=CC=C12)C3=NN4C(=O)/C(=C\C5=CC(=C(C(=C5)OC)OC)OC)/SC4=N3 |
Product Overview
RefChem:404237 (CAS 606953-02-0), with molecular formula C23H19N3O5S and molecular weight 449.10 g/mol. IUPAC: (5E)-2-(3-methyl-1-benzofuran-2-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of RefChem:404237
Property Insights of RefChem:404237
The XLogP value of 3.44612 indicates that RefChem:404237 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.09 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:404237. Following Lipinski's Rule of Five, RefChem:404237 has 0 hydrogen bond donor(s) and 8 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:404237?
The CAS number of RefChem:404237 is 606953-02-0.
What is the molecular formula of RefChem:404237?
The molecular formula of RefChem:404237 is C23H19N3O5S.
What is the molecular weight of RefChem:404237?
The molecular weight of RefChem:404237 is 449.10 g/mol.
Where can I buy RefChem:404237?
You can request a quote for RefChem:404237 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404237?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404237 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.