4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide
TL;DR: 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide (CAS 338394-12-0) is a chemical compound with molecular formula C22H21F6N3O4 and molecular weight 505.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide
Also Known As: 2B-084, 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide, 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenyltetrahydro-1(2H)-pyrazinecarboxamide, 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenyl-piperazine-1-carboxamide
| Molecular Formula | C22H21F6N3O4 |
|---|---|
| Molecular Weight | 505.14 g/mol |
| LogP | 4.5587 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.14362 |
| Heavy Atoms | 35 |
| Complexity | 1022.0865 |
Chemical Identifiers
| CAS Number | 338394-12-0 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=C(C=CC(=C2)OCC(F)(F)F)OCC(F)(F)F)C(=O)NC3=CC=CC=C3 |
Product Overview
4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide (CAS 338394-12-0), with molecular formula C22H21F6N3O4 and molecular weight 505.14 g/mol. IUPAC: 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide.
Chemical Property Profile of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide
Property Insights of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide
The XLogP value of 4.5587 indicates that 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide. Following Lipinski's Rule of Five, 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide?
The CAS number of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide is 338394-12-0.
What is the molecular formula of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide?
The molecular formula of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide is C22H21F6N3O4.
What is the molecular weight of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide?
The molecular weight of 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide is 505.14 g/mol.
Where can I buy 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide?
You can request a quote for 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[2,5-bis(2,2,2-trifluoroethoxy)benzoyl]-N-phenylpiperazine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.