3-Methyl-1-(4-nitrophenyl)piperazine
TL;DR: 3-Methyl-1-(4-nitrophenyl)piperazine (CAS 329922-44-3) 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.
3-methyl-1-(4-nitrophenyl)piperazine
Also Known As: 3-methyl-1-(4-nitrophenyl)piperazine, TOS-BB-0544, 3-Methyl-1-(4-nitro-phenyl)-piperazine, BAS 00805293, Piperazine,3-methyl-1-(4-nitrophenyl)-
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 1.3929 |
| Topological Polar Surface Area | 58.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 377.32098 |
Chemical Identifiers
| CAS Number | 329922-44-3 |
|---|---|
| SMILES | CC1CN(CCN1)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
3-Methyl-1-(4-nitrophenyl)piperazine (CAS 329922-44-3), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: 3-methyl-1-(4-nitrophenyl)piperazine.
Chemical Property Profile of 3-Methyl-1-(4-nitrophenyl)piperazine
Property Insights of 3-Methyl-1-(4-nitrophenyl)piperazine
The XLogP value of 1.3929 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-(4-nitrophenyl)piperazine. With a topological polar surface area (TPSA) of 58.41 Ų, 3-Methyl-1-(4-nitrophenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1-(4-nitrophenyl)piperazine has 1 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 3-Methyl-1-(4-nitrophenyl)piperazine?
The CAS number of 3-Methyl-1-(4-nitrophenyl)piperazine is 329922-44-3.
What is the molecular formula of 3-Methyl-1-(4-nitrophenyl)piperazine?
The molecular formula of 3-Methyl-1-(4-nitrophenyl)piperazine is C11H15N3O2.
What is the molecular weight of 3-Methyl-1-(4-nitrophenyl)piperazine?
The molecular weight of 3-Methyl-1-(4-nitrophenyl)piperazine is 221.12 g/mol.
Where can I buy 3-Methyl-1-(4-nitrophenyl)piperazine?
You can request a quote for 3-Methyl-1-(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 3-Methyl-1-(4-nitrophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-(4-nitrophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.