1-(4-Bromobenzoyl)piperidine
TL;DR: 1-(4-Bromobenzoyl)piperidine (CAS 2989084-72-0) is a chemical compound with molecular formula C12H14BrNO and molecular weight 267.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)-piperidin-1-ylmethanone
Also Known As: 1-(4-Bromobenzoyl)piperidine, (4-Bromo-phenyl)-piperidin-1-yl-methanone, Piperidine, 1-(4-bromobenzoyl)-, (4-bromophenyl)(piperidin-1-yl)methanone, (4-bromophenyl)-piperidin-1-ylmethanone
| Molecular Formula | C12H14BrNO |
|---|---|
| Molecular Weight | 267.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.02588 |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 2989084-72-0 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br |
| InChIKey | IXWFXRPZWAIOTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Bromobenzoyl)piperidine (CAS 2989084-72-0), with molecular formula C12H14BrNO and molecular weight 267.03 g/mol. IUPAC: (4-bromophenyl)-piperidin-1-ylmethanone.
Chemical Property Profile of 1-(4-Bromobenzoyl)piperidine
Property Insights of 1-(4-Bromobenzoyl)piperidine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromobenzoyl)piperidine. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(4-Bromobenzoyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromobenzoyl)piperidine has 0 hydrogen bond donor(s) and 1 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 1-(4-Bromobenzoyl)piperidine?
The CAS number of 1-(4-Bromobenzoyl)piperidine is 2989084-72-0.
What is the molecular formula of 1-(4-Bromobenzoyl)piperidine?
The molecular formula of 1-(4-Bromobenzoyl)piperidine is C12H14BrNO.
What is the molecular weight of 1-(4-Bromobenzoyl)piperidine?
The molecular weight of 1-(4-Bromobenzoyl)piperidine is 267.03 g/mol.
Where can I buy 1-(4-Bromobenzoyl)piperidine?
You can request a quote for 1-(4-Bromobenzoyl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromobenzoyl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromobenzoyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.