RefChem:340831
TL;DR: RefChem:340831 (CAS 99153-49-8) is a chemical compound with molecular formula C18H32Cl2N2O5 and molecular weight 426.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]ethoxy]ethanol;dihydrochloride
Also Known As: 2-(2-(4-((2,3,4-Trimethoxyphenyl)methyl)-1-piperazinyl)ethoxy)ethanol dihydrochloride, N-2-(2-Hydroxyethoxy)ethyl-N'-2,3,4-trimethoxybenzylpiperazine dihydrochloride, Ethanol, 2-(2-(4-((2,3,4-trimethoxyphenyl)methyl)-1-piperazinyl)ethoxy)-, dihydrochloride, 2-[2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]ethoxy]ethanol dihydrochloride, 2-(2-{4-[(2,3,4-Trimethoxyphenyl)methyl]piperazin-1-yl}ethoxy)ethan-1-ol--hydrogen chloride (1/2)
| Molecular Formula | C18H32Cl2N2O5 |
|---|---|
| Molecular Weight | 426.17 g/mol |
| LogP | 1.6825 |
| Topological Polar Surface Area | 63.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 426.16882 |
| Heavy Atoms | 27 |
| Complexity | 528.7186 |
Chemical Identifiers
| CAS Number | 99153-49-8 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)CN2CCN(CC2)CCOCCO)OC)OC.Cl.Cl |
Product Overview
RefChem:340831 (CAS 99153-49-8), with molecular formula C18H32Cl2N2O5 and molecular weight 426.17 g/mol. IUPAC: 2-[2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]ethoxy]ethanol;dihydrochloride.
Chemical Property Profile of RefChem:340831
Property Insights of RefChem:340831
The XLogP value of 1.6825 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:340831. The TPSA of 63.63 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:340831. Following Lipinski's Rule of Five, RefChem:340831 has 1 hydrogen bond donor(s) and 7 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:340831?
The CAS number of RefChem:340831 is 99153-49-8.
What is the molecular formula of RefChem:340831?
The molecular formula of RefChem:340831 is C18H32Cl2N2O5.
What is the molecular weight of RefChem:340831?
The molecular weight of RefChem:340831 is 426.17 g/mol.
Where can I buy RefChem:340831?
You can request a quote for RefChem:340831 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:340831?
Yes, KEHONG BIO provides custom synthesis services for RefChem:340831 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.