![(E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one structure](/static/products/425/425413-29-2.png)
(E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
TL;DR: (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 425413-29-2) is a chemical compound with molecular formula C21H16N4OS and molecular weight 372.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one, (2E)-2-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
| Molecular Formula | C21H16N4OS |
|---|---|
| Molecular Weight | 372.10 g/mol |
| LogP | 3.25944 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 372.1045 |
| Heavy Atoms | 27 |
| Complexity | 1409.7184 |
Chemical Identifiers
| CAS Number | 425413-29-2 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CN=CC=C2)C)/C=C/3\C(=O)N4C5=CC=CC=C5N=C4S3 |
Product Overview
(E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 425413-29-2), with molecular formula C21H16N4OS and molecular weight 372.10 g/mol. IUPAC: (2E)-2-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
Property Insights of (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
The XLogP value of 3.25944 indicates that (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)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 52.19 Ų, (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)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-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one has 0 hydrogen bond donor(s) and 4 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-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The CAS number of (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 425413-29-2.
What is the molecular formula of (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular formula of (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is C21H16N4OS.
What is the molecular weight of (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular weight of (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 372.10 g/mol.
Where can I buy (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
You can request a quote for (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)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-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl)methylene)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.