1-Methyl-4-(2-nitrophenyl)piperazine
TL;DR: 1-Methyl-4-(2-nitrophenyl)piperazine (CAS 62208-63-3) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-(2-nitrophenyl)piperazine
Also Known As: 1-methyl-4-(2-nitrophenyl)piperazine, 2-(4-Methyl-1-piperazinyl)aniline, Piperazine, 1-methyl-4-(2-nitrophenyl)-, 1-Methyl-4-(2-nitro-phenyl)-piperazine, 2-(4-Methylpiperazin-1-yl) nitrobenzene
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 62208-63-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | SSRLRVMFEGGGMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-4-(2-nitrophenyl)piperazine (CAS 62208-63-3), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: 1-methyl-4-(2-nitrophenyl)piperazine.
Chemical Property Profile of 1-Methyl-4-(2-nitrophenyl)piperazine
Property Insights of 1-Methyl-4-(2-nitrophenyl)piperazine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-(2-nitrophenyl)piperazine. With a topological polar surface area (TPSA) of 52.3 Ų, 1-Methyl-4-(2-nitrophenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-(2-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-Methyl-4-(2-nitrophenyl)piperazine?
The CAS number of 1-Methyl-4-(2-nitrophenyl)piperazine is 62208-63-3.
What is the molecular formula of 1-Methyl-4-(2-nitrophenyl)piperazine?
The molecular formula of 1-Methyl-4-(2-nitrophenyl)piperazine is C11H15N3O2.
What is the molecular weight of 1-Methyl-4-(2-nitrophenyl)piperazine?
The molecular weight of 1-Methyl-4-(2-nitrophenyl)piperazine is 221.12 g/mol.
Where can I buy 1-Methyl-4-(2-nitrophenyl)piperazine?
You can request a quote for 1-Methyl-4-(2-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-Methyl-4-(2-nitrophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-(2-nitrophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.