(Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
TL;DR: (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 347375-10-4) is a chemical compound with molecular formula C22H16N4O3S and molecular weight 416.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one, (2Z)-2-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one, (2Z)-2-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, 2-{(Z)-1-[2,5-DIMETHYL-1-(4-NITROPHENYL)-1H-PYRROL-3-YL]METHYLIDENE}[1,3]THIAZOLO[3,2-A][1,3]BENZIMIDAZOL-3-ONE, 2-{[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylene}-1,3-thiazolidino[3,2- a]benzimidazol-3-one
| Molecular Formula | C22H16N4O3S |
|---|---|
| Molecular Weight | 416.09 g/mol |
| LogP | 3.77264 |
| Topological Polar Surface Area | 82.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 416.0943 |
| Heavy Atoms | 30 |
| Complexity | 1558.2604 |
Chemical Identifiers
| CAS Number | 347375-10-4 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C)/C=C\3/C(=O)N4C5=CC=CC=C5N=C4S3 |
Product Overview
(Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one (CAS 347375-10-4), with molecular formula C22H16N4O3S and molecular weight 416.09 g/mol. IUPAC: (2Z)-2-[[2,5-dimethyl-1-(4-nitrophenyl)pyrrol-3-yl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
Property Insights of (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
The XLogP value of 3.77264 indicates that (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-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. The TPSA of 82.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one. Following Lipinski's Rule of Five, (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one has 0 hydrogen bond donor(s) and 5 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 (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The CAS number of (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 347375-10-4.
What is the molecular formula of (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular formula of (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is C22H16N4O3S.
What is the molecular weight of (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
The molecular weight of (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one is 416.09 g/mol.
Where can I buy (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
You can request a quote for (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-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 (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl)methylene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-((2,5-dimethyl-1-(4-nitrophenyl)-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.