4-(4-oxopiperidine-1-carbonyl)benzoic Acid
TL;DR: 4-(4-oxopiperidine-1-carbonyl)benzoic Acid (CAS 672309-93-2) is a chemical compound with molecular formula C13H13NO4 and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-oxopiperidine-1-carbonyl)benzoic acid
Also Known As: n-(4-carboxylic)benzoyl-4-piperidone, 4-(4-oxopiperidine-1-carbonyl)benzoic Acid, N-(4'-Carboxylic)benzoyl-4-piperidone, 4-(4-Oxopiperidine-1-carbonyl)benzoicacid, N-(4'-Carboxy)benzoyl-4-piperidone
| Molecular Formula | C13H13NO4 |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 1.1899 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.08446 |
| Heavy Atoms | 18 |
| Complexity | 482.21765 |
Chemical Identifiers
| CAS Number | 672309-93-2 |
|---|---|
| SMILES | C1CN(CCC1=O)C(=O)C2=CC=C(C=C2)C(=O)O |
Product Overview
4-(4-oxopiperidine-1-carbonyl)benzoic Acid (CAS 672309-93-2), with molecular formula C13H13NO4 and molecular weight 247.08 g/mol. IUPAC: 4-(4-oxopiperidine-1-carbonyl)benzoic acid.
Chemical Property Profile of 4-(4-oxopiperidine-1-carbonyl)benzoic Acid
Property Insights of 4-(4-oxopiperidine-1-carbonyl)benzoic Acid
The XLogP value of 1.1899 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-oxopiperidine-1-carbonyl)benzoic Acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-oxopiperidine-1-carbonyl)benzoic Acid. Following Lipinski's Rule of Five, 4-(4-oxopiperidine-1-carbonyl)benzoic Acid has 1 hydrogen bond donor(s) and 3 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 4-(4-oxopiperidine-1-carbonyl)benzoic Acid?
The CAS number of 4-(4-oxopiperidine-1-carbonyl)benzoic Acid is 672309-93-2.
What is the molecular formula of 4-(4-oxopiperidine-1-carbonyl)benzoic Acid?
The molecular formula of 4-(4-oxopiperidine-1-carbonyl)benzoic Acid is C13H13NO4.
What is the molecular weight of 4-(4-oxopiperidine-1-carbonyl)benzoic Acid?
The molecular weight of 4-(4-oxopiperidine-1-carbonyl)benzoic Acid is 247.08 g/mol.
Where can I buy 4-(4-oxopiperidine-1-carbonyl)benzoic Acid?
You can request a quote for 4-(4-oxopiperidine-1-carbonyl)benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-oxopiperidine-1-carbonyl)benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-oxopiperidine-1-carbonyl)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.