![1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine structure](/static/products/7186/718603-46-4.webp)
1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
TL;DR: 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine (CAS 718603-46-4) is a chemical compound with molecular formula C15H13BrF3N3O4S2 and molecular weight 498.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Also Known As: 1-(5-bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine, 1-[(5-bromothiophen-2-yl)sulfonyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
| Molecular Formula | C15H13BrF3N3O4S2 |
|---|---|
| Molecular Weight | 498.95 g/mol |
| LogP | 3.9485 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 498.9483 |
| Heavy Atoms | 28 |
| Complexity | 1002.2003 |
Chemical Identifiers
| CAS Number | 718603-46-4 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C3=CC=C(S3)Br |
Product Overview
1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine (CAS 718603-46-4), with molecular formula C15H13BrF3N3O4S2 and molecular weight 498.95 g/mol. IUPAC: 1-(5-bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine.
Chemical Property Profile of 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Property Insights of 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
The XLogP value of 3.9485 indicates that 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine. Following Lipinski's Rule of Five, 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]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-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine?
The CAS number of 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine is 718603-46-4.
What is the molecular formula of 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine?
The molecular formula of 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine is C15H13BrF3N3O4S2.
What is the molecular weight of 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine?
The molecular weight of 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine is 498.95 g/mol.
Where can I buy 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine?
You can request a quote for 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Bromothiophen-2-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.