1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine
TL;DR: 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine (CAS 376604-94-3) is a chemical compound with molecular formula C19H22FN3O4 and molecular weight 375.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-(4-fluorophenyl)piperazine
Also Known As: AB00076976-01, 1-(4,5-dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine, 1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-(4-fluorophenyl)piperazine, 1-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-4-(4-fluorophenyl)piperazine
| Molecular Formula | C19H22FN3O4 |
|---|---|
| Molecular Weight | 375.16 g/mol |
| LogP | 3.0733 |
| Topological Polar Surface Area | 68.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.15942 |
| Heavy Atoms | 27 |
| Complexity | 805.3472 |
Chemical Identifiers
| CAS Number | 376604-94-3 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)CN2CCN(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-])OC |
Product Overview
1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine (CAS 376604-94-3), with molecular formula C19H22FN3O4 and molecular weight 375.16 g/mol. IUPAC: 1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-(4-fluorophenyl)piperazine.
Chemical Property Profile of 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine
Property Insights of 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine
The XLogP value of 3.0733 indicates that 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine. Following Lipinski's Rule of Five, 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)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-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine?
The CAS number of 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine is 376604-94-3.
What is the molecular formula of 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine?
The molecular formula of 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine is C19H22FN3O4.
What is the molecular weight of 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine?
The molecular weight of 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine is 375.16 g/mol.
Where can I buy 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine?
You can request a quote for 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,5-Dimethoxy-2-nitrobenzyl)-4-(4-fluorophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.