3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide
TL;DR: 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide (CAS 438529-46-5) is a chemical compound with molecular formula C12H15N5O5 and molecular weight 309.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylpiperazin-1-yl)-3,5-dinitrobenzamide
Also Known As: 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide, N-(4-methylpiperazin-1-yl)-3,5-dinitrobenzamide, N-(4-METHYLPIPERAZINO)-3,5-DINITROBENZAMIDE, (3,5-dinitrophenyl)-N-(4-methylpiperazinyl)carboxamide
| Molecular Formula | C12H15N5O5 |
|---|---|
| Molecular Weight | 309.11 g/mol |
| LogP | 0.3952 |
| Topological Polar Surface Area | 121.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.10733 |
| Heavy Atoms | 22 |
| Complexity | 579.67456 |
Chemical Identifiers
| CAS Number | 438529-46-5 |
|---|---|
| SMILES | CN1CCN(CC1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide (CAS 438529-46-5), with molecular formula C12H15N5O5 and molecular weight 309.11 g/mol. IUPAC: N-(4-methylpiperazin-1-yl)-3,5-dinitrobenzamide.
Chemical Property Profile of 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide
Property Insights of 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide
The XLogP value of 0.3952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide. The TPSA of 121.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide. Following Lipinski's Rule of Five, 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide has 1 hydrogen bond donor(s) and 7 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 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide?
The CAS number of 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide is 438529-46-5.
What is the molecular formula of 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide?
The molecular formula of 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide is C12H15N5O5.
What is the molecular weight of 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide?
The molecular weight of 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide is 309.11 g/mol.
Where can I buy 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide?
You can request a quote for 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dinitro-N-(4-methyl-1-piperazinyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.