RefChem:1058833
TL;DR: RefChem:1058833 (CAS 101221-48-1) is a chemical compound with molecular formula C26H46Cl2N2O2 and molecular weight 488.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-[3-[2-hydroxyethyl(methyl)amino]-1-adamantyl]-1-adamantyl]-methylamino]ethanol;dihydrochloride
Also Known As: Ethanol, 2,2'-((1,1'-biadamantane)-3,3'-diyl)bis(methylimino)di-, dihydrochloride, 2,2'-((1,1'-Biadamantane)-3,3'-diyl)bis(methylimino)di-ethanol dihydrochloride, Ethanol, 2,2'-1,1'-bitricyclo(3.3.1.1(sup 3,7))decane-3,3'-diylbis(methylimino)bis-, 2HCl, 2-[[3-[3-[2-hydroxyethyl(methyl)amino]-1-adamantyl]-1-adamantyl]-methylamino]ethanol dihydrochloride, 2-[[3-[3-[2-hydroxyethyl(methyl)amino]-1-adamantyl]-1-adamantyl]-methylamino]ethanol
| Molecular Formula | C26H46Cl2N2O2 |
|---|---|
| Molecular Weight | 488.29 g/mol |
| LogP | 4.36 |
| Topological Polar Surface Area | 46.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 488.29364 |
| Heavy Atoms | 32 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 101221-48-1 |
|---|---|
| SMILES | CN(CCO)C12CC3CC(C1)CC(C3)(C2)C45CC6CC(C4)CC(C6)(C5)N(C)CCO.Cl.Cl |
| InChIKey | ADNOXTGIKQXGLJ-UHFFFAOYSA-N |
Product Overview
RefChem:1058833 (CAS 101221-48-1), with molecular formula C26H46Cl2N2O2 and molecular weight 488.29 g/mol. IUPAC: 2-[[3-[3-[2-hydroxyethyl(methyl)amino]-1-adamantyl]-1-adamantyl]-methylamino]ethanol;dihydrochloride.
Chemical Property Profile of RefChem:1058833
Property Insights of RefChem:1058833
The XLogP value of 4.36 indicates that RefChem:1058833 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.9 Ų, RefChem:1058833 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1058833 has 4 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 RefChem:1058833?
The CAS number of RefChem:1058833 is 101221-48-1.
What is the molecular formula of RefChem:1058833?
The molecular formula of RefChem:1058833 is C26H46Cl2N2O2.
What is the molecular weight of RefChem:1058833?
The molecular weight of RefChem:1058833 is 488.29 g/mol.
Where can I buy RefChem:1058833?
You can request a quote for RefChem:1058833 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058833?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058833 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.