1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
TL;DR: 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine (CAS 428829-26-9) is a chemical compound with molecular formula C16H26N2O5S and molecular weight 358.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylsulfonyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine
Also Known As: BAS 03152487, 1-(ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine, 1-ethylsulfonyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine, 1-Ethanesulfonyl-4-(3,4,5-trimethoxy-benzyl)-piperazine, 1-(ETHANESULFONYL)-4-[(3,4,5-TRIMETHOXYPHENYL)METHYL]PIPERAZINE
| Molecular Formula | C16H26N2O5S |
|---|---|
| Molecular Weight | 358.16 g/mol |
| LogP | 1.1797 |
| Topological Polar Surface Area | 68.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.15625 |
| Heavy Atoms | 24 |
| Complexity | 629.42676 |
Chemical Identifiers
| CAS Number | 428829-26-9 |
|---|---|
| SMILES | CCS(=O)(=O)N1CCN(CC1)CC2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine (CAS 428829-26-9), with molecular formula C16H26N2O5S and molecular weight 358.16 g/mol. IUPAC: 1-ethylsulfonyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine.
Chemical Property Profile of 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
Property Insights of 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
The XLogP value of 1.1797 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine. The TPSA of 68.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine. Following Lipinski's Rule of Five, 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine 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 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
The CAS number of 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine is 428829-26-9.
What is the molecular formula of 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
The molecular formula of 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine is C16H26N2O5S.
What is the molecular weight of 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
The molecular weight of 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine is 358.16 g/mol.
Where can I buy 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
You can request a quote for 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Ethylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.