Peralopride
TL;DR: Peralopride (CAS 57083-89-3) is a chemical compound with molecular formula C20H22ClN3O4 and molecular weight 403.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-5-chloro-2-methoxyphenyl)-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methanone
Also Known As: Peralopride, Peraloprida, Peralopridum, peralopride[inn], Peralopride [INN]
| Molecular Formula | C20H22ClN3O4 |
|---|---|
| Molecular Weight | 403.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 77.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.12988 |
| Heavy Atoms | 28 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 57083-89-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)Cl)N |
| InChIKey | XBYVCKARLGAKEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Peralopride (CAS 57083-89-3), with molecular formula C20H22ClN3O4 and molecular weight 403.13 g/mol. IUPAC: (4-amino-5-chloro-2-methoxyphenyl)-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methanone.
Chemical Property Profile of Peralopride
Property Insights of Peralopride
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Peralopride. The TPSA of 77.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Peralopride. Following Lipinski's Rule of Five, Peralopride has 1 hydrogen bond donor(s) and 6 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 Peralopride?
The CAS number of Peralopride is 57083-89-3.
What is the molecular formula of Peralopride?
The molecular formula of Peralopride is C20H22ClN3O4.
What is the molecular weight of Peralopride?
The molecular weight of Peralopride is 403.13 g/mol.
Where can I buy Peralopride?
You can request a quote for Peralopride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Peralopride?
Yes, KEHONG BIO provides custom synthesis services for Peralopride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.