RefChem:368829
TL;DR: RefChem:368829 (CAS 2989-24-4) is a chemical compound with molecular formula C17H29Cl2NO2 and molecular weight 349.16 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)propyl-ethylamino]ethanol;hydrochloride
Also Known As: WV 0052, Phenetole, 4-chloro-beta-(N-(2-chloroethyl)-N-ethylamino)-alpha,5-dimethyl-2-isopropyl-, hydrochloride, 4-Chloro-beta-(N-(2-chloroethyl)-N-ethylamino)-alpha,5-dimethyl-2-isopropylphenetole HCl, p-Cymene, 2-chloro-5-(1-(N-(2-chloroethyl)-N-ethylamino)-2-propoxy)-, hydrochloride, Ethanol, 2-[[2-[(6-chlorothymyl)oxy]propyl]ethylamino]-, hydrochloride
| Molecular Formula | C17H29Cl2NO2 |
|---|---|
| Molecular Weight | 349.16 g/mol |
| LogP | 4.27512 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 349.15753 |
| Heavy Atoms | 22 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 2989-24-4 |
|---|---|
| SMILES | CCN(CCO)CC(C)OC1=C(C=C(C(=C1)C)Cl)C(C)C.Cl |
| InChIKey | WZDGBDNOWUDXRA-UHFFFAOYSA-N |
Product Overview
RefChem:368829 (CAS 2989-24-4), with molecular formula C17H29Cl2NO2 and molecular weight 349.16 g/mol. IUPAC: 2-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)propyl-ethylamino]ethanol;hydrochloride.
Chemical Property Profile of RefChem:368829
Property Insights of RefChem:368829
The XLogP value of 4.27512 indicates that RefChem:368829 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, RefChem:368829 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:368829 has 2 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:368829?
The CAS number of RefChem:368829 is 2989-24-4.
What is the molecular formula of RefChem:368829?
The molecular formula of RefChem:368829 is C17H29Cl2NO2.
What is the molecular weight of RefChem:368829?
The molecular weight of RefChem:368829 is 349.16 g/mol.
Where can I buy RefChem:368829?
You can request a quote for RefChem:368829 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:368829?
Yes, KEHONG BIO provides custom synthesis services for RefChem:368829 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.