![(E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one structure](/static/products/593/593275-13-9.png)
(E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
TL;DR: (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 593275-13-9) is a chemical compound with molecular formula C22H21N3O3S and molecular weight 407.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one, (2E)-2-[(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one, 2-{(E)-1-[2,5-DIMETHOXY-4-(1-PYRROLIDINYL)PHENYL]METHYLIDENE}[1,3]THIAZOLO[3,2-A][1,3]BENZIMIDAZOL-3(2H)-ONE
| Molecular Formula | C22H21N3O3S |
|---|---|
| Molecular Weight | 407.13 g/mol |
| LogP | 3.0743 |
| Topological Polar Surface Area | 56.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.13037 |
| Heavy Atoms | 29 |
| Complexity | 1318.8164 |
Chemical Identifiers
| CAS Number | 593275-13-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1/C=C/2\C(=O)N3C4=CC=CC=C4N=C3S2)OC)N5CCCC5 |
Product Overview
(E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 593275-13-9), with molecular formula C22H21N3O3S and molecular weight 407.13 g/mol. IUPAC: (2E)-2-[(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
Property Insights of (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
The XLogP value of 3.0743 indicates that (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)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 56.07 Ų, (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)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-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one 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 (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The CAS number of (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 593275-13-9.
What is the molecular formula of (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular formula of (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is C22H21N3O3S.
What is the molecular weight of (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular weight of (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 407.13 g/mol.
Where can I buy (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
You can request a quote for (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)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-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene)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.