1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine
TL;DR: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine (CAS 343375-56-4) is a chemical compound with molecular formula C14H14F3N5O6S and molecular weight 437.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitroethenyl)piperazine
Also Known As: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine, 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitroethenyl)piperazine, 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-[1-(methylsulfanyl)-2-nitrovinyl]piperazine
| Molecular Formula | C14H14F3N5O6S |
|---|---|
| Molecular Weight | 437.06 g/mol |
| LogP | 3.0824 |
| Topological Polar Surface Area | 135.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.06168 |
| Heavy Atoms | 29 |
| Complexity | 834.7838 |
Chemical Identifiers
| CAS Number | 343375-56-4 |
|---|---|
| SMILES | CSC(=C[N+](=O)[O-])N1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] |
Product Overview
1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine (CAS 343375-56-4), with molecular formula C14H14F3N5O6S and molecular weight 437.06 g/mol. IUPAC: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitroethenyl)piperazine.
Chemical Property Profile of 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine
Property Insights of 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine
The XLogP value of 3.0824 indicates that 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine. Following Lipinski's Rule of Five, 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine has 0 hydrogen bond donor(s) and 9 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-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine?
The CAS number of 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine is 343375-56-4.
What is the molecular formula of 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine?
The molecular formula of 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine is C14H14F3N5O6S.
What is the molecular weight of 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine?
The molecular weight of 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine is 437.06 g/mol.
Where can I buy 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine?
You can request a quote for 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(1-methylsulfanyl-2-nitro-ethenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.