2-Acetamido-5-oxo-5-phenylpentanoic acid
TL;DR: 2-Acetamido-5-oxo-5-phenylpentanoic acid (CAS 3066-84-0) is a chemical compound with molecular formula C13H15NO4 and molecular weight 249.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-5-oxo-5-phenylpentanoic acid
Also Known As: 2-acetamido-5-oxo-5-phenylpentanoic acid, 2-acetamido-5-oxo-5-phenyl-pentanoicacid, DL-2-Acetamino-4-benzoyl-buttersaeure, 2-(acetylamino)-5-oxo-5-phenylpentanoic acid, Benzenepentanoic acid, a-(acetylamino)-d-oxo-
| Molecular Formula | C13H15NO4 |
|---|---|
| Molecular Weight | 249.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 249.10011 |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 3066-84-0 |
|---|---|
| SMILES | CC(=O)NC(CCC(=O)C1=CC=CC=C1)C(=O)O |
| InChIKey | HYMHQWHWVZXOKO-UHFFFAOYSA-N |
Product Overview
2-Acetamido-5-oxo-5-phenylpentanoic acid (CAS 3066-84-0), with molecular formula C13H15NO4 and molecular weight 249.10 g/mol. IUPAC: 2-acetamido-5-oxo-5-phenylpentanoic acid.
Chemical Property Profile of 2-Acetamido-5-oxo-5-phenylpentanoic acid
Property Insights of 2-Acetamido-5-oxo-5-phenylpentanoic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetamido-5-oxo-5-phenylpentanoic acid. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetamido-5-oxo-5-phenylpentanoic acid. Following Lipinski's Rule of Five, 2-Acetamido-5-oxo-5-phenylpentanoic acid has 2 hydrogen bond donor(s) and 4 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-Acetamido-5-oxo-5-phenylpentanoic acid?
The CAS number of 2-Acetamido-5-oxo-5-phenylpentanoic acid is 3066-84-0.
What is the molecular formula of 2-Acetamido-5-oxo-5-phenylpentanoic acid?
The molecular formula of 2-Acetamido-5-oxo-5-phenylpentanoic acid is C13H15NO4.
What is the molecular weight of 2-Acetamido-5-oxo-5-phenylpentanoic acid?
The molecular weight of 2-Acetamido-5-oxo-5-phenylpentanoic acid is 249.10 g/mol.
Where can I buy 2-Acetamido-5-oxo-5-phenylpentanoic acid?
You can request a quote for 2-Acetamido-5-oxo-5-phenylpentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetamido-5-oxo-5-phenylpentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetamido-5-oxo-5-phenylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.