2-(1-Benzoylpiperidin-4-yl)acetic acid
TL;DR: 2-(1-Benzoylpiperidin-4-yl)acetic acid (CAS 56772-11-3) is a chemical compound with molecular formula C14H17NO3 and molecular weight 247.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzoylpiperidin-4-yl)acetic acid
Also Known As: 1-Benzoyl-4-piperidineacetic acid, 2-(1-benzoylpiperidin-4-yl)acetic acid, 1-Benzoyl-4-piperidineaceticacid, 4-Piperidineacetic acid, 1-benzoyl-, (1-Benzoyl-4-piperidinyl)acetic acid
| Molecular Formula | C14H17NO3 |
|---|---|
| Molecular Weight | 247.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.12085 |
| Heavy Atoms | 18 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 56772-11-3 |
|---|---|
| SMILES | C1CN(CCC1CC(=O)O)C(=O)C2=CC=CC=C2 |
| InChIKey | KXHGWYZKPOTYOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1-Benzoylpiperidin-4-yl)acetic acid (CAS 56772-11-3), with molecular formula C14H17NO3 and molecular weight 247.12 g/mol. IUPAC: 2-(1-benzoylpiperidin-4-yl)acetic acid.
Chemical Property Profile of 2-(1-Benzoylpiperidin-4-yl)acetic acid
Property Insights of 2-(1-Benzoylpiperidin-4-yl)acetic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Benzoylpiperidin-4-yl)acetic acid. With a topological polar surface area (TPSA) of 57.6 Ų, 2-(1-Benzoylpiperidin-4-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Benzoylpiperidin-4-yl)acetic 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 2-(1-Benzoylpiperidin-4-yl)acetic acid?
The CAS number of 2-(1-Benzoylpiperidin-4-yl)acetic acid is 56772-11-3.
What is the molecular formula of 2-(1-Benzoylpiperidin-4-yl)acetic acid?
The molecular formula of 2-(1-Benzoylpiperidin-4-yl)acetic acid is C14H17NO3.
What is the molecular weight of 2-(1-Benzoylpiperidin-4-yl)acetic acid?
The molecular weight of 2-(1-Benzoylpiperidin-4-yl)acetic acid is 247.12 g/mol.
Where can I buy 2-(1-Benzoylpiperidin-4-yl)acetic acid?
You can request a quote for 2-(1-Benzoylpiperidin-4-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Benzoylpiperidin-4-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Benzoylpiperidin-4-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.