(Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one
TL;DR: (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one (CAS 377059-08-0) is a chemical compound with molecular formula C20H12Cl2N4O4 and molecular weight 442.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5-one
Also Known As: (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one, (4Z)-4-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5(4H)-one, (4Z)-4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5-one
| Molecular Formula | C20H12Cl2N4O4 |
|---|---|
| Molecular Weight | 442.02 g/mol |
| LogP | 4.74022 |
| Topological Polar Surface Area | 99.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.02356 |
| Heavy Atoms | 30 |
| Complexity | 1249.1924 |
Chemical Identifiers
| CAS Number | 377059-08-0 |
|---|---|
| SMILES | CC1=NN(C(=C1/C=C\2/C(=O)OC(=N2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])Cl)C4=CC=CC=C4 |
Product Overview
(Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one (CAS 377059-08-0), with molecular formula C20H12Cl2N4O4 and molecular weight 442.02 g/mol. IUPAC: (4Z)-4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5-one.
Chemical Property Profile of (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one
Property Insights of (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one
The XLogP value of 4.74022 indicates that (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.62 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one. Following Lipinski's Rule of Five, (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-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 (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one?
The CAS number of (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one is 377059-08-0.
What is the molecular formula of (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one?
The molecular formula of (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one is C20H12Cl2N4O4.
What is the molecular weight of (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one?
The molecular weight of (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one is 442.02 g/mol.
Where can I buy (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one?
You can request a quote for (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(4-chloro-3-nitrophenyl)oxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.