Paxistil
TL;DR: Paxistil (CAS 5978-92-7) is a chemical compound with molecular formula C44H41ClN2O7 and molecular weight 744.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-[2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid
Also Known As: Paxistil, Hydroxyzine pamoate, Hydroxyzine pamoate (ester), 4-[[3-[2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid, 2-Naphthoic acid, 4,4'-methylenebis(3-hydroxy-, ester with 2-(2-(4-(p-chloro-alpha-phenylbenzyl)-1-piperazinyl)-ethoxy)ethanol
| Molecular Formula | C44H41ClN2O7 |
|---|---|
| Molecular Weight | 744.26 g/mol |
| LogP | 7.4 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 14 |
| Exact Mass | 744.26025 |
| Heavy Atoms | 54 |
| Complexity | 1190.0 |
Chemical Identifiers
| CAS Number | 5978-92-7 |
|---|---|
| SMILES | C1CN(CCN1CCOCCOC(=O)C2=CC3=CC=CC=C3C(=C2O)CC4=C(C(=CC5=CC=CC=C54)C(=O)O)O)C(C6=CC=CC=C6)C7=CC=C(C=C7)Cl |
| InChIKey | YENRTVJWRCAGEM-UHFFFAOYSA-N |
Product Overview
Paxistil (CAS 5978-92-7), with molecular formula C44H41ClN2O7 and molecular weight 744.26 g/mol. IUPAC: 4-[[3-[2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethoxycarbonyl]-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid.
Chemical Property Profile of Paxistil
Property Insights of Paxistil
The XLogP value of 7.4 indicates that Paxistil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Paxistil. Following Lipinski's Rule of Five, Paxistil has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Paxistil?
The CAS number of Paxistil is 5978-92-7.
What is the molecular formula of Paxistil?
The molecular formula of Paxistil is C44H41ClN2O7.
What is the molecular weight of Paxistil?
The molecular weight of Paxistil is 744.26 g/mol.
Where can I buy Paxistil?
You can request a quote for Paxistil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Paxistil?
Yes, KEHONG BIO provides custom synthesis services for Paxistil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.