1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine
TL;DR: 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine (CAS 681852-36-8) is a chemical compound with molecular formula C22H32N2O3S and molecular weight 404.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-4-(2-methoxy-4-methylphenyl)sulfonylpiperazine
Also Known As: VU0159616-6, 1-(adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine, 1-(1-adamantyl)-4-(2-methoxy-4-methylphenyl)sulfonylpiperazine, A2938/0123703, 1-(1-adamantyl)-4-[(2-methoxy-4-methylphenyl)sulfonyl]piperazine
| Molecular Formula | C22H32N2O3S |
|---|---|
| Molecular Weight | 404.21 g/mol |
| LogP | 3.27872 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.21338 |
| Heavy Atoms | 28 |
| Complexity | 823.24866 |
Chemical Identifiers
| CAS Number | 681852-36-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)OC |
Product Overview
1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine (CAS 681852-36-8), with molecular formula C22H32N2O3S and molecular weight 404.21 g/mol. IUPAC: 1-(1-adamantyl)-4-(2-methoxy-4-methylphenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine
Property Insights of 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine
The XLogP value of 3.27872 indicates that 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine has 0 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 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine?
The CAS number of 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine is 681852-36-8.
What is the molecular formula of 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine?
The molecular formula of 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine is C22H32N2O3S.
What is the molecular weight of 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine?
The molecular weight of 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine is 404.21 g/mol.
Where can I buy 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine?
You can request a quote for 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Adamantan-1-yl)-4-(2-methoxy-4-methylbenzenesulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.