![2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid structure](/static/products/289/28993-73-9.png)
2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid
TL;DR: 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid (CAS 28993-73-9) is a chemical compound with molecular formula C31H49N3O4 and molecular weight 527.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]icosanoic acid
Also Known As: BAS 01118496, 2-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]icosanoic acid, 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid, 2-(2-OXO-2-((5-OXO-1-PH-4,5-DIHYDRO-1H-PYRAZOL-3-YL)AMINO)ETHYL)ICOSANOIC ACID, 2-(2-oxo-2-((5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)amino)ethyl)icosanoic acid
| Molecular Formula | C31H49N3O4 |
|---|---|
| Molecular Weight | 527.37 g/mol |
| LogP | 7.5955 |
| Topological Polar Surface Area | 99.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 21 |
| Exact Mass | 527.3723 |
| Heavy Atoms | 38 |
| Complexity | 855.94037 |
Chemical Identifiers
| CAS Number | 28993-73-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCC(CC(=O)NC1=NN(C(=O)C1)C2=CC=CC=C2)C(=O)O |
Product Overview
2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid (CAS 28993-73-9), with molecular formula C31H49N3O4 and molecular weight 527.37 g/mol. IUPAC: 2-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]icosanoic acid.
Chemical Property Profile of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid
Property Insights of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid
The XLogP value of 7.5955 indicates that 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid. Following Lipinski's Rule of Five, 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid?
The CAS number of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid is 28993-73-9.
What is the molecular formula of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid?
The molecular formula of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid is C31H49N3O4.
What is the molecular weight of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid?
The molecular weight of 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid is 527.37 g/mol.
Where can I buy 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid?
You can request a quote for 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)carbamoyl]methyl}icosanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.