Pruvanserin hydrochloride
TL;DR: Pruvanserin hydrochloride (CAS 443144-27-2) is a chemical compound with molecular formula C22H22ClFN4O and molecular weight 412.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1H-indole-3-carbonitrile;hydrochloride
Also Known As: Pruvanserin hydrochloride, Pruvanserin HCl, EMD 281014 hydrochloride, Pruvanserin (hydrochloride), EMD-281014 hydrochloride
| Molecular Formula | C22H22ClFN4O |
|---|---|
| Molecular Weight | 412.15 g/mol |
| LogP | 3.60098 |
| Topological Polar Surface Area | 63.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.1466 |
| Heavy Atoms | 29 |
| Complexity | 1033.1421 |
Chemical Identifiers
| CAS Number | 443144-27-2 |
|---|---|
| SMILES | C1CN(CCN1CCC2=CC=C(C=C2)F)C(=O)C3=CC=CC4=C3NC=C4C#N.Cl |
Product Overview
Pruvanserin hydrochloride (CAS 443144-27-2), with molecular formula C22H22ClFN4O and molecular weight 412.15 g/mol. IUPAC: 7-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1H-indole-3-carbonitrile;hydrochloride.
Chemical Property Profile of Pruvanserin hydrochloride
Property Insights of Pruvanserin hydrochloride
The XLogP value of 3.60098 indicates that Pruvanserin hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Pruvanserin hydrochloride. Following Lipinski's Rule of Five, Pruvanserin hydrochloride 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 Pruvanserin hydrochloride?
The CAS number of Pruvanserin hydrochloride is 443144-27-2.
What is the molecular formula of Pruvanserin hydrochloride?
The molecular formula of Pruvanserin hydrochloride is C22H22ClFN4O.
What is the molecular weight of Pruvanserin hydrochloride?
The molecular weight of Pruvanserin hydrochloride is 412.15 g/mol.
Where can I buy Pruvanserin hydrochloride?
You can request a quote for Pruvanserin hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pruvanserin hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pruvanserin hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.