1,4-Bis(trichloroacetyl)piperazine
TL;DR: 1,4-Bis(trichloroacetyl)piperazine (CAS 6964-92-7) is a chemical compound with molecular formula C8H8Cl6N2O2 and molecular weight 373.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trichloro-1-[4-(2,2,2-trichloroacetyl)piperazin-1-yl]ethanone
Also Known As: KST-1B7731, 1,1'-piperazine-1,4-diylbis(trichloroethanone), 1,4-BIS(TRICHLOROACETYL)PIPERAZINE, 2,2,2-trichloro-1-[4-(2,2,2-trichloroacetyl)piperazin-1-yl]ethanone, 1,1'-(Piperazine-1,4-diyl)bis(trichloroethan-1-one)
| Molecular Formula | C8H8Cl6N2O2 |
|---|---|
| Molecular Weight | 373.87 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 373.8717 |
| Heavy Atoms | 18 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 6964-92-7 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C(Cl)(Cl)Cl)C(=O)C(Cl)(Cl)Cl |
| InChIKey | PQYIBUUHNHPHRO-UHFFFAOYSA-N |
Product Overview
1,4-Bis(trichloroacetyl)piperazine (CAS 6964-92-7), with molecular formula C8H8Cl6N2O2 and molecular weight 373.87 g/mol. IUPAC: 2,2,2-trichloro-1-[4-(2,2,2-trichloroacetyl)piperazin-1-yl]ethanone.
Chemical Property Profile of 1,4-Bis(trichloroacetyl)piperazine
Property Insights of 1,4-Bis(trichloroacetyl)piperazine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Bis(trichloroacetyl)piperazine. With a topological polar surface area (TPSA) of 40.6 Ų, 1,4-Bis(trichloroacetyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis(trichloroacetyl)piperazine has 0 hydrogen bond donor(s) and 2 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 1,4-Bis(trichloroacetyl)piperazine?
The CAS number of 1,4-Bis(trichloroacetyl)piperazine is 6964-92-7.
What is the molecular formula of 1,4-Bis(trichloroacetyl)piperazine?
The molecular formula of 1,4-Bis(trichloroacetyl)piperazine is C8H8Cl6N2O2.
What is the molecular weight of 1,4-Bis(trichloroacetyl)piperazine?
The molecular weight of 1,4-Bis(trichloroacetyl)piperazine is 373.87 g/mol.
Where can I buy 1,4-Bis(trichloroacetyl)piperazine?
You can request a quote for 1,4-Bis(trichloroacetyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(trichloroacetyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(trichloroacetyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.