2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
TL;DR: 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one (CAS 434290-89-8) is a chemical compound with molecular formula C16H20F3N3O3 and molecular weight 359.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
Also Known As: 2,2-dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one, 2,2-dimethyl-1-{4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl}propan-1-one
| Molecular Formula | C16H20F3N3O3 |
|---|---|
| Molecular Weight | 359.15 g/mol |
| LogP | 3.3083 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.1457 |
| Heavy Atoms | 25 |
| Complexity | 675.4281 |
Chemical Identifiers
| CAS Number | 434290-89-8 |
|---|---|
| SMILES | CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F |
Product Overview
2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one (CAS 434290-89-8), with molecular formula C16H20F3N3O3 and molecular weight 359.15 g/mol. IUPAC: 2,2-dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one.
Chemical Property Profile of 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
Property Insights of 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
The XLogP value of 3.3083 indicates that 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one. Following Lipinski's Rule of Five, 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one has 0 hydrogen bond donor(s) and 4 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 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one?
The CAS number of 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one is 434290-89-8.
What is the molecular formula of 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one?
The molecular formula of 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one is C16H20F3N3O3.
What is the molecular weight of 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one?
The molecular weight of 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one is 359.15 g/mol.
Where can I buy 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one?
You can request a quote for 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-1-[4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.