bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride
TL;DR: bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride (CAS 352444-92-9) is a chemical compound with molecular formula C22H40Cl2N2O4 and molecular weight 466.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 2-[3-[2-[2-(dimethylamino)ethoxy]-2-oxoethyl]-1-adamantyl]acetate;dihydrochloride
Also Known As: bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride, 2-dimethylaminoethyl 2-[3-[2-(2-dimethylaminoethyloxy)-2-oxoethyl]-1-adamantyl]acetate dihydrochloride
| Molecular Formula | C22H40Cl2N2O4 |
|---|---|
| Molecular Weight | 466.24 g/mol |
| LogP | 3.4064 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 466.2365 |
| Heavy Atoms | 30 |
| Complexity | 525.48486 |
Chemical Identifiers
| CAS Number | 352444-92-9 |
|---|---|
| SMILES | CN(C)CCOC(=O)CC12CC3CC(C1)CC(C3)(C2)CC(=O)OCCN(C)C.Cl.Cl |
Product Overview
bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride (CAS 352444-92-9), with molecular formula C22H40Cl2N2O4 and molecular weight 466.24 g/mol. IUPAC: 2-(dimethylamino)ethyl 2-[3-[2-[2-(dimethylamino)ethoxy]-2-oxoethyl]-1-adamantyl]acetate;dihydrochloride.
Chemical Property Profile of bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride
Property Insights of bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride
The XLogP value of 3.4064 indicates that bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.08 Ų, bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride has 0 hydrogen bond donor(s) and 6 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 bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride?
The CAS number of bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride is 352444-92-9.
What is the molecular formula of bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride?
The molecular formula of bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride is C22H40Cl2N2O4.
What is the molecular weight of bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride?
The molecular weight of bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride is 466.24 g/mol.
Where can I buy bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride?
You can request a quote for bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for bis(2-(dimethylamino)ethyl) 2,2'-((1s,3s,5r,7r)-adamantane-1,3-diyl)diacetate dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.