2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid
TL;DR: 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid (CAS 511307-39-4) is a chemical compound with molecular formula C13H16N2O6 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-5-(2-hydroxy-5-nitroanilino)-5-oxopentanoic acid
Also Known As: 2-ethyl-5-(2-hydroxy-5-nitroanilino)-5-oxopentanoic acid, 2-ethyl-4-[(2-hydroxy-5-nitro-phenyl)carbamoyl]butanoic Acid, 2-ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid, 2-ethyl-5-[(2-hydroxy-5-nitrophenyl)amino]-5-oxopentanoic acid
| Molecular Formula | C13H16N2O6 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 2.1299 |
| Topological Polar Surface Area | 129.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 296.10083 |
| Heavy Atoms | 21 |
| Complexity | 557.5925 |
Chemical Identifiers
| CAS Number | 511307-39-4 |
|---|---|
| SMILES | CCC(CCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])O)C(=O)O |
Product Overview
2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid (CAS 511307-39-4), with molecular formula C13H16N2O6 and molecular weight 296.10 g/mol. IUPAC: 2-ethyl-5-(2-hydroxy-5-nitroanilino)-5-oxopentanoic acid.
Chemical Property Profile of 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid
Property Insights of 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid
The XLogP value of 2.1299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid. The TPSA of 129.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid. Following Lipinski's Rule of Five, 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid has 3 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 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid?
The CAS number of 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid is 511307-39-4.
What is the molecular formula of 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid?
The molecular formula of 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid is C13H16N2O6.
What is the molecular weight of 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid?
The molecular weight of 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid is 296.10 g/mol.
Where can I buy 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid?
You can request a quote for 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-5-((2-hydroxy-5-nitrophenyl)amino)-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.