Remoxipride Hydrochloride
TL;DR: Remoxipride Hydrochloride (CAS 117591-79-4) is a chemical compound with molecular formula C16H26BrClN2O4 and molecular weight 424.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxybenzamide;hydrate;hydrochloride
Also Known As: Remoxipride HCl, Roxiam, REMOXIPRIDE HYDROCHLORIDE, Roxiam ir, A 33547.HCl.H2O
| Molecular Formula | C16H26BrClN2O4 |
|---|---|
| Molecular Weight | 424.08 g/mol |
| LogP | 2.28 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.07645 |
| Heavy Atoms | 24 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 117591-79-4 |
|---|---|
| SMILES | CCN1CCC[C@H]1CNC(=O)C2=C(C=CC(=C2OC)Br)OC.O.Cl |
| InChIKey | SPFVHFBNXPARTR-IDMXKUIJSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Remoxipride Hydrochloride (CAS 117591-79-4), with molecular formula C16H26BrClN2O4 and molecular weight 424.08 g/mol. IUPAC: 3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxybenzamide;hydrate;hydrochloride.
Chemical Property Profile of Remoxipride Hydrochloride
Property Insights of Remoxipride Hydrochloride
The XLogP value of 2.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Remoxipride Hydrochloride. With a topological polar surface area (TPSA) of 51.8 Ų, Remoxipride Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Remoxipride Hydrochloride has 3 hydrogen bond donor(s) and 5 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 Remoxipride Hydrochloride?
The CAS number of Remoxipride Hydrochloride is 117591-79-4.
What is the molecular formula of Remoxipride Hydrochloride?
The molecular formula of Remoxipride Hydrochloride is C16H26BrClN2O4.
What is the molecular weight of Remoxipride Hydrochloride?
The molecular weight of Remoxipride Hydrochloride is 424.08 g/mol.
Where can I buy Remoxipride Hydrochloride?
You can request a quote for Remoxipride Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Remoxipride Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Remoxipride Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.