Mebeverine Hydrochloride
TL;DR: Mebeverine Hydrochloride (CAS 2753-45-9) is a chemical compound with molecular formula C25H36ClNO5 and molecular weight 465.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[ethyl-[1-(4-methoxyphenyl)propan-2-yl]amino]butyl 3,4-dimethoxybenzoate;hydrochloride
Also Known As: MEBEVERINE HYDROCHLORIDE, Mebeverine HCl, Colofac, Duspatalin, Duspatal
| Molecular Formula | C25H36ClNO5 |
|---|---|
| Molecular Weight | 465.23 g/mol |
| LogP | 5.02 |
| Topological Polar Surface Area | 57.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 465.2282 |
| Heavy Atoms | 32 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 2753-45-9 |
|---|---|
| SMILES | CCN(CCCCOC(=O)C1=CC(=C(C=C1)OC)OC)C(C)CC2=CC=C(C=C2)OC.Cl |
| InChIKey | PLGQWYOULXPJRE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mebeverine Hydrochloride (CAS 2753-45-9), with molecular formula C25H36ClNO5 and molecular weight 465.23 g/mol. IUPAC: 4-[ethyl-[1-(4-methoxyphenyl)propan-2-yl]amino]butyl 3,4-dimethoxybenzoate;hydrochloride.
Chemical Property Profile of Mebeverine Hydrochloride
Property Insights of Mebeverine Hydrochloride
The XLogP value of 5.02 indicates that Mebeverine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.2 Ų, Mebeverine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mebeverine Hydrochloride has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mebeverine Hydrochloride?
The CAS number of Mebeverine Hydrochloride is 2753-45-9.
What is the molecular formula of Mebeverine Hydrochloride?
The molecular formula of Mebeverine Hydrochloride is C25H36ClNO5.
What is the molecular weight of Mebeverine Hydrochloride?
The molecular weight of Mebeverine Hydrochloride is 465.23 g/mol.
Where can I buy Mebeverine Hydrochloride?
You can request a quote for Mebeverine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mebeverine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Mebeverine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.