(3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone
TL;DR: (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone (CAS 466683-33-0) is a chemical compound with molecular formula C18H31ClN2O and molecular weight 326.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethyl-1-adamantyl)-(4-methylpiperazin-1-yl)methanone;hydrochloride
Also Known As: (3,5-dimethyl-1-adamantyl)-(4-methylpiperazin-1-yl)methanone Hydrochloride, (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone, ((1r,3R,5S,7r)-3,5-dimethyladamantan-1-yl)(4-methylpiperazin-1-yl)methanone hydrochloride
| Molecular Formula | C18H31ClN2O |
|---|---|
| Molecular Weight | 326.21 g/mol |
| LogP | 3.1788 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.2125 |
| Heavy Atoms | 22 |
| Complexity | 453.7076 |
Chemical Identifiers
| CAS Number | 466683-33-0 |
|---|---|
| SMILES | CC12CC3CC(C1)(CC(C3)(C2)C(=O)N4CCN(CC4)C)C.Cl |
Product Overview
(3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone (CAS 466683-33-0), with molecular formula C18H31ClN2O and molecular weight 326.21 g/mol. IUPAC: (3,5-dimethyl-1-adamantyl)-(4-methylpiperazin-1-yl)methanone;hydrochloride.
Chemical Property Profile of (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone
Property Insights of (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone
The XLogP value of 3.1788 indicates that (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone has 0 hydrogen bond donor(s) and 2 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 (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone?
The CAS number of (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone is 466683-33-0.
What is the molecular formula of (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone?
The molecular formula of (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone is C18H31ClN2O.
What is the molecular weight of (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone?
The molecular weight of (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone is 326.21 g/mol.
Where can I buy (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone?
You can request a quote for (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone?
Yes, KEHONG BIO provides custom synthesis services for (3,5-Dimethyl-adamantan-1-yl)-(4-methyl-piperazin-1-yl)-methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.