羟嗪
TL;DR: 羟嗪 (CAS 68-88-2) is a chemical compound with molecular formula C21H27ClN2O2 and molecular weight 374.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟嗪
2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethanol
Also Known As: hydroxyzine, Hydroxizine, Hydroxyzin, Hydroxycine, Hydroxine
| Molecular Formula | C21H27ClN2O2 |
|---|---|
| Molecular Weight | 374.18 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 35.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 374.17612 |
| Heavy Atoms | 26 |
| Complexity | 376.0 |
| Melting Point | 200C |
| Boiling Point | 220 °C at 0.5 mm Hg |
| Solubility | Crystals; MP 193 °C; Bitter taste. Solubility in mg/mL: water <700; chloroform 60; acetone 2; ether <0.1. Solutions are unstable to intense UV light. /Hydroxyzine dihydrochloride/ |
Chemical Identifiers
| CAS Number | 68-88-2 |
|---|---|
| SMILES | C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl |
| InChIKey | ZQDWXGKKHFNSQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟嗪 (CAS 68-88-2), with molecular formula C21H27ClN2O2 and molecular weight 374.18 g/mol. IUPAC: 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethanol.
Chemical Property Profile of 羟嗪
Property Insights of 羟嗪
The XLogP value of 3.7 indicates that 羟嗪 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, 羟嗪 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 羟嗪 has 1 hydrogen bond donor(s) and 4 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 羟嗪?
The CAS number of 羟嗪 is 68-88-2.
What is the molecular formula of 羟嗪?
The molecular formula of 羟嗪 is C21H27ClN2O2.
What is the molecular weight of 羟嗪?
The molecular weight of 羟嗪 is 374.18 g/mol.
Where can I buy 羟嗪?
You can request a quote for 羟嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟嗪?
Yes, KEHONG BIO provides custom synthesis services for 羟嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.