Benzetimide
TL;DR: Benzetimide (CAS 14051-33-3) is a chemical compound with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzylpiperidin-4-yl)-3-phenylpiperidine-2,6-dione
Also Known As: Benzetimide, Benzetimidum, Spasmental, bencetimida, Benzezimida
| Molecular Formula | C23H26N2O2 |
|---|---|
| Molecular Weight | 362.20 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.19943 |
| Heavy Atoms | 27 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 14051-33-3 |
|---|---|
| SMILES | C1CN(CCC1C2(CCC(=O)NC2=O)C3=CC=CC=C3)CC4=CC=CC=C4 |
| InChIKey | LQQIVYSCPWCSSD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzetimide (CAS 14051-33-3), with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol. IUPAC: 3-(1-benzylpiperidin-4-yl)-3-phenylpiperidine-2,6-dione.
Chemical Property Profile of Benzetimide
Property Insights of Benzetimide
The XLogP value of 3.1 indicates that Benzetimide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, Benzetimide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzetimide 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 Benzetimide?
The CAS number of Benzetimide is 14051-33-3.
What is the molecular formula of Benzetimide?
The molecular formula of Benzetimide is C23H26N2O2.
What is the molecular weight of Benzetimide?
The molecular weight of Benzetimide is 362.20 g/mol.
Where can I buy Benzetimide?
You can request a quote for Benzetimide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzetimide?
Yes, KEHONG BIO provides custom synthesis services for Benzetimide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.