(E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
TL;DR: (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 573695-04-2) is a chemical compound with molecular formula C24H15Cl3N2O3S and molecular weight 515.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one, (2E)-2-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
| Molecular Formula | C24H15Cl3N2O3S |
|---|---|
| Molecular Weight | 515.99 g/mol |
| LogP | 6.0047 |
| Topological Polar Surface Area | 52.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 515.9869 |
| Heavy Atoms | 33 |
| Complexity | 1628.0883 |
Chemical Identifiers
| CAS Number | 573695-04-2 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)/C=C/2\C(=O)N3C4=CC=CC=C4N=C3S2)Cl)OCC5=CC(=C(C=C5)Cl)Cl |
Product Overview
(E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 573695-04-2), with molecular formula C24H15Cl3N2O3S and molecular weight 515.99 g/mol. IUPAC: (2E)-2-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
Property Insights of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
The XLogP value of 6.0047 indicates that (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.83 Ų, (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The CAS number of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 573695-04-2.
What is the molecular formula of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular formula of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is C24H15Cl3N2O3S.
What is the molecular weight of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular weight of (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 515.99 g/mol.
Where can I buy (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
You can request a quote for (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(3-chloro-4-((3,4-dichlorobenzyl)oxy)-5-methoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.