1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine
TL;DR: 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine (CAS 428847-95-4) is a chemical compound with molecular formula C12H18N2O4S2 and molecular weight 318.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfonyl-4-methylsulfonylpiperazine
Also Known As: 1-(benzylsulfonyl)-4-(methylsulfonyl)piperazine, BAS 03152738, 1-benzylsulfonyl-4-methylsulfonylpiperazine, 1-(methylsulfonyl)-4-[benzylsulfonyl]piperazine, 1-Methanesulfonyl-4-phenylmethanesulfonyl-piperazine
| Molecular Formula | C12H18N2O4S2 |
|---|---|
| Molecular Weight | 318.07 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 91.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.0708 |
| Heavy Atoms | 20 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 428847-95-4 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2 |
| InChIKey | DUUILCKKZUITFW-UHFFFAOYSA-N |
Product Overview
1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine (CAS 428847-95-4), with molecular formula C12H18N2O4S2 and molecular weight 318.07 g/mol. IUPAC: 1-benzylsulfonyl-4-methylsulfonylpiperazine.
Chemical Property Profile of 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine
Property Insights of 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine. The TPSA of 91.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine. Following Lipinski's Rule of Five, 1-(Benzylsulfonyl)-4-(methylsulfonyl)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-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine?
The CAS number of 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine is 428847-95-4.
What is the molecular formula of 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine?
The molecular formula of 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine is C12H18N2O4S2.
What is the molecular weight of 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine?
The molecular weight of 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine is 318.07 g/mol.
Where can I buy 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine?
You can request a quote for 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylsulfonyl)-4-(methylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.