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2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene
TL;DR: 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene (CAS 446028-41-7) is a chemical compound with molecular formula C20H26Cl2N2O2S and molecular weight 428.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-4-(2,5-dichlorophenyl)sulfonylpiperazine
Also Known As: 2-[(4-adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene, A2792/0117973, 1-(1-adamantyl)-4-(2,5-dichlorophenyl)sulfonylpiperazine, 1-(adamantan-1-yl)-4-(2,5-dichlorobenzenesulfonyl)piperazine, 1-[(2,5-dichlorophenyl)sulfonyl]-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazine
| Molecular Formula | C20H26Cl2N2O2S |
|---|---|
| Molecular Weight | 428.11 g/mol |
| LogP | 4.2685 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.1092 |
| Heavy Atoms | 27 |
| Complexity | 814.25354 |
Chemical Identifiers
| CAS Number | 446028-41-7 |
|---|---|
| SMILES | C1CN(CCN1C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=C(C=CC(=C5)Cl)Cl |
Product Overview
2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene (CAS 446028-41-7), with molecular formula C20H26Cl2N2O2S and molecular weight 428.11 g/mol. IUPAC: 1-(1-adamantyl)-4-(2,5-dichlorophenyl)sulfonylpiperazine.
Chemical Property Profile of 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene
Property Insights of 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene
The XLogP value of 4.2685 indicates that 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene has 0 hydrogen bond donor(s) and 3 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 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene?
The CAS number of 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene is 446028-41-7.
What is the molecular formula of 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene?
The molecular formula of 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene is C20H26Cl2N2O2S.
What is the molecular weight of 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene?
The molecular weight of 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene is 428.11 g/mol.
Where can I buy 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene?
You can request a quote for 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Adamantanylpiperazinyl)sulfonyl]-1,4-dichlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.