![2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid structure](/static/products/7079/70793-47-4.webp)
2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid
TL;DR: 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid (CAS 70793-47-4) is a chemical compound with molecular formula C22H21N5O6 and molecular weight 451.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid
Also Known As: 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid, 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H, 2-[(E)-(1-{3-[(2-Ethoxyphenyl)amino]-3-oxopropanoyl}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl)diazenyl]benzoic acid, 2-[(E)-[1-[3-(2-ethoxyanilino)-3-oxo-propanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzoic acid, 2-[(E)-{1-[3-(2-Ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl}diazenyl]benzoic acid
| Molecular Formula | C22H21N5O6 |
|---|---|
| Molecular Weight | 451.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 451.14917 |
| Heavy Atoms | 33 |
| Complexity | 828.0 |
Chemical Identifiers
| CAS Number | 70793-47-4 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC(=O)CC(=O)N2C(=O)C(C(=N2)C)N=NC3=CC=CC=C3C(=O)O |
| InChIKey | KQVVSDSWLSPFGY-UHFFFAOYSA-N |
Product Overview
2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid (CAS 70793-47-4), with molecular formula C22H21N5O6 and molecular weight 451.15 g/mol. IUPAC: 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid.
Chemical Property Profile of 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid
Property Insights of 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid
The XLogP value of 3.0 indicates that 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid has 2 hydrogen bond donor(s) and 9 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 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid?
The CAS number of 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid is 70793-47-4.
What is the molecular formula of 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid?
The molecular formula of 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid is C22H21N5O6.
What is the molecular weight of 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid?
The molecular weight of 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid is 451.15 g/mol.
Where can I buy 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid?
You can request a quote for 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.