Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride
TL;DR: Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride (CAS 23479-49-4) is a chemical compound with molecular formula C23H33ClN2O2 and molecular weight 404.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride
Also Known As: KETONE, 1-ADAMANTYL (4-(o-METHOXYPHENYL)-1-PIPERAZINYL)METHYL, MONOHYDROCHLORIDE, 1-Adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl ketone monohydrochloride, 1-(1-adamantyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone hydrochloride, Ketone, 1-adamantyl [4-(o-methoxyphenyl)-1-piperazinyl]methyl, monohydrochloride, 1-(Adamantan-1-yl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one--hydrogen chloride (1/1)
| Molecular Formula | C23H33ClN2O2 |
|---|---|
| Molecular Weight | 404.22 g/mol |
| LogP | 4.02 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.22305 |
| Heavy Atoms | 28 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 23479-49-4 |
|---|---|
| SMILES | COC1=CC=CC=C1N2CCN(CC2)CC(=O)C34CC5CC(C3)CC(C5)C4.Cl |
| InChIKey | PXMQKTKQGRJMFJ-UHFFFAOYSA-N |
Product Overview
Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride (CAS 23479-49-4), with molecular formula C23H33ClN2O2 and molecular weight 404.22 g/mol. IUPAC: 1-(1-adamantyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone;hydrochloride.
Chemical Property Profile of Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride
Property Insights of Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride
The XLogP value of 4.02 indicates that Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride has 1 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 Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride?
The CAS number of Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride is 23479-49-4.
What is the molecular formula of Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride?
The molecular formula of Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride is C23H33ClN2O2.
What is the molecular weight of Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride?
The molecular weight of Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride is 404.22 g/mol.
Where can I buy Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride?
You can request a quote for Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ketone, 1-adamantyl (4-(o-methoxyphenyl)-1-piperazinyl)methyl, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.