RefChem:319068
TL;DR: RefChem:319068 (CAS 66902-79-2) is a chemical compound with molecular formula C23H32Cl3NO2 and molecular weight 459.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)ethoxy]ethyl-[(4-chlorophenyl)methyl]-dimethylazanium chloride
Also Known As: Ammonium, (p-chlorobenzyl)(2-(2-(4-chloro-2-isopropyl-5-methylphenoxy)ethoxy)ethyl)dimethyl-, chloride, 2-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)ethoxy]ethyl-[(4-chlorophenyl)methyl]-dimethylazanium chloride, AMMONIUM, (p-CHLOROBENZYL)(2-(2-(4-CHLORO-2-ISOPROPYL-5-METHYLPHENOXY)ETHOXY)ETH, 2-{2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxy]ethoxy}-N-[(4-chlorophenyl)methyl]-N,N-dimethylethan-1-aminium chloride, Benzenemethanaminium, 4-chloro-N-[2-[2-[4-chloro-5-methyl-2-(1-methylethyl)phenoxy]ethoxy]ethyl]-N,N-dimethyl-, chloride
| Molecular Formula | C23H32Cl3NO2 |
|---|---|
| Molecular Weight | 459.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 459.14987 |
| Heavy Atoms | 29 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 66902-79-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OCCOCC[N+](C)(C)CC2=CC=C(C=C2)Cl.[Cl-] |
| InChIKey | UARYXXNSPIEPEH-UHFFFAOYSA-M |
Product Overview
RefChem:319068 (CAS 66902-79-2), with molecular formula C23H32Cl3NO2 and molecular weight 459.15 g/mol. IUPAC: 2-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)ethoxy]ethyl-[(4-chlorophenyl)methyl]-dimethylazanium chloride.
Chemical Property Profile of RefChem:319068
Property Insights of RefChem:319068
The XLogP value of 3.1 indicates that RefChem:319068 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, RefChem:319068 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319068 has 0 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 RefChem:319068?
The CAS number of RefChem:319068 is 66902-79-2.
What is the molecular formula of RefChem:319068?
The molecular formula of RefChem:319068 is C23H32Cl3NO2.
What is the molecular weight of RefChem:319068?
The molecular weight of RefChem:319068 is 459.15 g/mol.
Where can I buy RefChem:319068?
You can request a quote for RefChem:319068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319068?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.