![Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate structure](/static/products/3753/375394-75-5.webp)
Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate
TL;DR: Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate (CAS 375394-75-5) is a chemical compound with molecular formula C25H20N2O5 and molecular weight 428.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-oxo-2-[[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylidene]butanoate
Also Known As: Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate, Ethyl 3-oxo-2-[[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]methylidene]butanoate, ethyl 3-oxo-2-[[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylidene]butanoate, Ethyl 3-oxo-2-{[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}butanoate
| Molecular Formula | C25H20N2O5 |
|---|---|
| Molecular Weight | 428.14 g/mol |
| LogP | 4.1812 |
| Topological Polar Surface Area | 91.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.1372 |
| Heavy Atoms | 32 |
| Complexity | 1396.8821 |
Chemical Identifiers
| CAS Number | 375394-75-5 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CN(N=C1C2=CC3=CC=CC=C3OC2=O)C4=CC=CC=C4)C(=O)C |
Product Overview
Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate (CAS 375394-75-5), with molecular formula C25H20N2O5 and molecular weight 428.14 g/mol. IUPAC: ethyl 3-oxo-2-[[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylidene]butanoate.
Chemical Property Profile of Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate
Property Insights of Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate
The XLogP value of 4.1812 indicates that Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate. Following Lipinski's Rule of Five, Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate 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 Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate?
The CAS number of Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate is 375394-75-5.
What is the molecular formula of Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate?
The molecular formula of Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate is C25H20N2O5.
What is the molecular weight of Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate?
The molecular weight of Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate is 428.14 g/mol.
Where can I buy Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate?
You can request a quote for Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-oxo-2-[[3-(2-oxo-2H-1-benzopyran-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.