RefChem:89161
TL;DR: RefChem:89161 (CAS 68938-75-0) is a chemical compound with molecular formula C21H48Cl2N2O3 and molecular weight 446.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diethylamino)-3-[1-(diethylamino)-3-(2-ethylpentoxy)propan-2-yl]oxypropan-2-ol;dihydrochloride
Also Known As: 1-Diethylamino-3-(1-diethylaminomethyl-2-(2-ethylamyloxy)ethoxy)-2-propanol, dihydrochloride, 1-3-[2-1-[[oxy]methyl]ethoxy]propan-2-oldihydrochloride, 1-(DIETHYLAMINO)-3-[2-(DIETHYLAMINO)-1-[[(2-ETHYLPENTYL)OXY]METHYL]ETHOXY]PROPAN-2-OL DIHYDROCHLORIDE, 2-Propanol, 1-(diethylamino)-3-(2-(diethylamino)-1-(((2-ethylpentyl)oxy)methyl)ethoxy)-, dihydrochloride, 2-Propanol, 1-(diethylamino)-3-(2-(diethylamino)-1-(((2-ethylpentyl)oxy)methyl)ethoxy)-, hydrochloride (1:2)
| Molecular Formula | C21H48Cl2N2O3 |
|---|---|
| Molecular Weight | 446.30 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 45.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 446.3042 |
| Heavy Atoms | 28 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 68938-75-0 |
|---|---|
| SMILES | CCCC(CC)COCC(CN(CC)CC)OCC(CN(CC)CC)O.Cl.Cl |
| InChIKey | AARYHHIOYWDSLJ-UHFFFAOYSA-N |
Product Overview
RefChem:89161 (CAS 68938-75-0), with molecular formula C21H48Cl2N2O3 and molecular weight 446.30 g/mol. IUPAC: 1-(diethylamino)-3-[1-(diethylamino)-3-(2-ethylpentoxy)propan-2-yl]oxypropan-2-ol;dihydrochloride.
Chemical Property Profile of RefChem:89161
Property Insights of RefChem:89161
The XLogP value of 4.1 indicates that RefChem:89161 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.2 Ų, RefChem:89161 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:89161 has 3 hydrogen bond donor(s) and 5 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:89161?
The CAS number of RefChem:89161 is 68938-75-0.
What is the molecular formula of RefChem:89161?
The molecular formula of RefChem:89161 is C21H48Cl2N2O3.
What is the molecular weight of RefChem:89161?
The molecular weight of RefChem:89161 is 446.30 g/mol.
Where can I buy RefChem:89161?
You can request a quote for RefChem:89161 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:89161?
Yes, KEHONG BIO provides custom synthesis services for RefChem:89161 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.