1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine
TL;DR: 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine (CAS 343375-58-6) is a chemical compound with molecular formula C14H19N3O2S and molecular weight 293.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine
Also Known As: 1-benzyl-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine, 1-benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine, 1-benzyl-4-[1-(methylsulfanyl)-2-nitrovinyl]piperazine
| Molecular Formula | C14H19N3O2S |
|---|---|
| Molecular Weight | 293.12 g/mol |
| LogP | 2.2428 |
| Topological Polar Surface Area | 49.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.1198 |
| Heavy Atoms | 20 |
| Complexity | 470.56717 |
Chemical Identifiers
| CAS Number | 343375-58-6 |
|---|---|
| SMILES | CSC(=C[N+](=O)[O-])N1CCN(CC1)CC2=CC=CC=C2 |
Product Overview
1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine (CAS 343375-58-6), with molecular formula C14H19N3O2S and molecular weight 293.12 g/mol. IUPAC: 1-benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine.
Chemical Property Profile of 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine
Property Insights of 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine
The XLogP value of 2.2428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine. With a topological polar surface area (TPSA) of 49.62 Ų, 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine has 0 hydrogen bond donor(s) and 5 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-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine?
The CAS number of 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine is 343375-58-6.
What is the molecular formula of 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine?
The molecular formula of 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine is C14H19N3O2S.
What is the molecular weight of 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine?
The molecular weight of 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine is 293.12 g/mol.
Where can I buy 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine?
You can request a quote for 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-4-(1-methylsulfanyl-2-nitroethenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.