1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine
TL;DR: 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine (CAS 444907-41-9) is a chemical compound with molecular formula C17H15F2N3O3 and molecular weight 347.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-difluorophenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone
Also Known As: 1-(2,6-difluorobenzoyl)-4-{4-nitrophenyl}piperazine, (2,6-difluorophenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone, 2,6-difluorophenyl 4-(4-nitrophenyl)piperazinyl ketone, (2,6-difluorophenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone, (2,6-DIFLUOROPHENYL)[4-(4-NITROPHENYL)PIPERAZINO]METHANONE
| Molecular Formula | C17H15F2N3O3 |
|---|---|
| Molecular Weight | 347.11 g/mol |
| LogP | 2.8354 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.10815 |
| Heavy Atoms | 25 |
| Complexity | 783.0354 |
Chemical Identifiers
| CAS Number | 444907-41-9 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C(C=CC=C3F)F |
Product Overview
1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine (CAS 444907-41-9), with molecular formula C17H15F2N3O3 and molecular weight 347.11 g/mol. IUPAC: (2,6-difluorophenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine
Property Insights of 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine
The XLogP value of 2.8354 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine. Following Lipinski's Rule of Five, 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine 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 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine?
The CAS number of 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine is 444907-41-9.
What is the molecular formula of 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine?
The molecular formula of 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine is C17H15F2N3O3.
What is the molecular weight of 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine?
The molecular weight of 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine is 347.11 g/mol.
Where can I buy 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine?
You can request a quote for 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}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-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Difluorobenzoyl)-4-{4-nitrophenyl}piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.