![1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine structure](/static/products/4296/429623-08-5.webp)
1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine
TL;DR: 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine (CAS 429623-08-5) is a chemical compound with molecular formula C17H20N4O2 and molecular weight 312.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine
Also Known As: 1-[(2-nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine, 1-(2-nitrobenzyl)-4-(pyridin-3-ylmethyl)piperazine, 1-[(2-nitrophenyl)methyl]-4-(3-pyridylmethyl)piperazine
| Molecular Formula | C17H20N4O2 |
|---|---|
| Molecular Weight | 312.16 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.15863 |
| Heavy Atoms | 23 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 429623-08-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=CN=CC=C2)CC3=CC=CC=C3[N+](=O)[O-] |
| InChIKey | RVUWSAZNEWKLNE-UHFFFAOYSA-N |
Product Overview
1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine (CAS 429623-08-5), with molecular formula C17H20N4O2 and molecular weight 312.16 g/mol. IUPAC: 1-[(2-nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine.
Chemical Property Profile of 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine
Property Insights of 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine. Following Lipinski's Rule of Five, 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine has 0 hydrogen bond donor(s) and 5 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-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine?
The CAS number of 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine is 429623-08-5.
What is the molecular formula of 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine?
The molecular formula of 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine is C17H20N4O2.
What is the molecular weight of 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine?
The molecular weight of 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine is 312.16 g/mol.
Where can I buy 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine?
You can request a quote for 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Nitrophenyl)methyl]-4-(pyridin-3-ylmethyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.