1,4-Bis(2-methyl-2-nitropropyl)piperazine
TL;DR: 1,4-Bis(2-methyl-2-nitropropyl)piperazine (CAS 97029-23-7) is a chemical compound with molecular formula C12H24N4O4 and molecular weight 288.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(2-methyl-2-nitropropyl)piperazine
Also Known As: 1,4-bis(2-methyl-2-nitropropyl)piperazine, NCIOpen2_002393, Piperazine, 1,4-bis(2-methyl-2-nitropropyl)-, 1,4-bis-(2-methyl-2-nitro-propyl)-piperazine, A1425/0063463
| Molecular Formula | C12H24N4O4 |
|---|---|
| Molecular Weight | 288.18 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 98.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.17975 |
| Heavy Atoms | 20 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 97029-23-7 |
|---|---|
| SMILES | CC(C)(CN1CCN(CC1)CC(C)(C)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | PYQLJAPEWWPYND-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Bis(2-methyl-2-nitropropyl)piperazine (CAS 97029-23-7), with molecular formula C12H24N4O4 and molecular weight 288.18 g/mol. IUPAC: 1,4-bis(2-methyl-2-nitropropyl)piperazine.
Chemical Property Profile of 1,4-Bis(2-methyl-2-nitropropyl)piperazine
Property Insights of 1,4-Bis(2-methyl-2-nitropropyl)piperazine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Bis(2-methyl-2-nitropropyl)piperazine. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis(2-methyl-2-nitropropyl)piperazine. Following Lipinski's Rule of Five, 1,4-Bis(2-methyl-2-nitropropyl)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-Bis(2-methyl-2-nitropropyl)piperazine?
The CAS number of 1,4-Bis(2-methyl-2-nitropropyl)piperazine is 97029-23-7.
What is the molecular formula of 1,4-Bis(2-methyl-2-nitropropyl)piperazine?
The molecular formula of 1,4-Bis(2-methyl-2-nitropropyl)piperazine is C12H24N4O4.
What is the molecular weight of 1,4-Bis(2-methyl-2-nitropropyl)piperazine?
The molecular weight of 1,4-Bis(2-methyl-2-nitropropyl)piperazine is 288.18 g/mol.
Where can I buy 1,4-Bis(2-methyl-2-nitropropyl)piperazine?
You can request a quote for 1,4-Bis(2-methyl-2-nitropropyl)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-Bis(2-methyl-2-nitropropyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(2-methyl-2-nitropropyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.