1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
TL;DR: 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine (CAS 423744-92-7) is a chemical compound with molecular formula C15H24N2O5S and molecular weight 344.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine
Also Known As: MixCom6_002031, BAS 02500575, 1-(methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine, BIM-0040049.P001, 1-methylsulfonyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine
| Molecular Formula | C15H24N2O5S |
|---|---|
| Molecular Weight | 344.14 g/mol |
| LogP | 0.7896 |
| Topological Polar Surface Area | 68.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.1406 |
| Heavy Atoms | 23 |
| Complexity | 614.26245 |
Chemical Identifiers
| CAS Number | 423744-92-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)S(=O)(=O)C |
Product Overview
1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine (CAS 423744-92-7), with molecular formula C15H24N2O5S and molecular weight 344.14 g/mol. IUPAC: 1-methylsulfonyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine.
Chemical Property Profile of 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
Property Insights of 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine
The XLogP value of 0.7896 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine. The TPSA of 68.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine. Following Lipinski's Rule of Five, 1-(Methylsulfonyl)-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-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
The CAS number of 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine is 423744-92-7.
What is the molecular formula of 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
The molecular formula of 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine is C15H24N2O5S.
What is the molecular weight of 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
The molecular weight of 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine is 344.14 g/mol.
Where can I buy 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
You can request a quote for 1-(Methylsulfonyl)-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-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methylsulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.