4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde
TL;DR: 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde (CAS 1024146-22-2) is a chemical compound with molecular formula C12H12N4O6 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,5-dinitrobenzoyl)piperazine-1-carbaldehyde
Also Known As: 4-(3,5-dinitrobenzoyl)piperazine-1-carbaldehyde, 4-((3,5-DINITROPHENYL)CARBONYL)PIPERAZINECARBALDEHYDE
| Molecular Formula | C12H12N4O6 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 0.4172 |
| Topological Polar Surface Area | 126.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.07568 |
| Heavy Atoms | 22 |
| Complexity | 606.2537 |
Chemical Identifiers
| CAS Number | 1024146-22-2 |
|---|---|
| SMILES | C1CN(CCN1C=O)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde (CAS 1024146-22-2), with molecular formula C12H12N4O6 and molecular weight 308.08 g/mol. IUPAC: 4-(3,5-dinitrobenzoyl)piperazine-1-carbaldehyde.
Chemical Property Profile of 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde
Property Insights of 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde
The XLogP value of 0.4172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde. The TPSA of 126.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde. Following Lipinski's Rule of Five, 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde 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 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde?
The CAS number of 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde is 1024146-22-2.
What is the molecular formula of 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde?
The molecular formula of 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde is C12H12N4O6.
What is the molecular weight of 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde?
The molecular weight of 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde is 308.08 g/mol.
Where can I buy 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde?
You can request a quote for 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,5-Dinitrobenzoyl)piperazine-1-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.