Benrixate
TL;DR: Benrixate (CAS 2881-90-5) is a chemical compound with molecular formula C19H30N2O2 and molecular weight 318.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-benzylpiperidine-1-carboxylate
Also Known As: Benrixate, Benrixato, Benrixatum, Benrixate [INN:DCF], BENRIXATE [INN]
| Molecular Formula | C19H30N2O2 |
|---|---|
| Molecular Weight | 318.23 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 318.23074 |
| Heavy Atoms | 23 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 2881-90-5 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)N1CCC(CC1)CC2=CC=CC=C2 |
| InChIKey | BSRXEULOHCMVFG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benrixate (CAS 2881-90-5), with molecular formula C19H30N2O2 and molecular weight 318.23 g/mol. IUPAC: 2-(diethylamino)ethyl 4-benzylpiperidine-1-carboxylate.
Chemical Property Profile of Benrixate
Property Insights of Benrixate
The XLogP value of 3.6 indicates that Benrixate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, Benrixate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benrixate 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 Benrixate?
The CAS number of Benrixate is 2881-90-5.
What is the molecular formula of Benrixate?
The molecular formula of Benrixate is C19H30N2O2.
What is the molecular weight of Benrixate?
The molecular weight of Benrixate is 318.23 g/mol.
Where can I buy Benrixate?
You can request a quote for Benrixate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benrixate?
Yes, KEHONG BIO provides custom synthesis services for Benrixate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.