4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester
TL;DR: 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester (CAS 160296-40-2) is a chemical compound with molecular formula C17H22FNO3 and molecular weight 307.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-(4-fluorobenzoyl)piperidine-1-carboxylate
Also Known As: tert-butyl 4-(4-fluorobenzoyl)piperidine-1-carboxylate, 1-Boc-4-(4-Fluorobenzoyl)piperidine, 1-Boc-4-(4-fluoro-benzoyl)-piperidine, 8081AA, tert-butyl4-(4-fluorobenzoyl)piperidine-1-carboxylate
| Molecular Formula | C17H22FNO3 |
|---|---|
| Molecular Weight | 307.16 g/mol |
| LogP | 3.6555 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.1584 |
| Heavy Atoms | 22 |
| Complexity | 540.01764 |
Chemical Identifiers
| CAS Number | 160296-40-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)C(=O)C2=CC=C(C=C2)F |
Product Overview
4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester (CAS 160296-40-2), with molecular formula C17H22FNO3 and molecular weight 307.16 g/mol. IUPAC: tert-butyl 4-(4-fluorobenzoyl)piperidine-1-carboxylate.
Chemical Property Profile of 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester
Property Insights of 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester
The XLogP value of 3.6555 indicates that 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester has 0 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-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester?
The CAS number of 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester is 160296-40-2.
What is the molecular formula of 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester?
The molecular formula of 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester is C17H22FNO3.
What is the molecular weight of 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester?
The molecular weight of 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester is 307.16 g/mol.
Where can I buy 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester?
You can request a quote for 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Fluoro-benzoyl)-piperidine-1-carboxylic acid tert-butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.