N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine
TL;DR: N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine (CAS 893617-06-6) is a chemical compound with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-N-(pyridin-4-ylmethyl)methanamine
Also Known As: N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine, 1-(4-nitrophenyl)-N-(pyridin-4-ylmethyl)methanamine
| Molecular Formula | C13H13N3O2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 2.2796 |
| Topological Polar Surface Area | 68.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.10077 |
| Heavy Atoms | 18 |
| Complexity | 511.51938 |
Chemical Identifiers
| CAS Number | 893617-06-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CNCC2=CC=NC=C2)[N+](=O)[O-] |
Product Overview
N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine (CAS 893617-06-6), with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol. IUPAC: 1-(4-nitrophenyl)-N-(pyridin-4-ylmethyl)methanamine.
Chemical Property Profile of N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine
Property Insights of N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine
The XLogP value of 2.2796 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine. The TPSA of 68.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine. Following Lipinski's Rule of Five, N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine 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 N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine?
The CAS number of N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine is 893617-06-6.
What is the molecular formula of N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine?
The molecular formula of N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine is C13H13N3O2.
What is the molecular weight of N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine?
The molecular weight of N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine is 243.10 g/mol.
Where can I buy N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine?
You can request a quote for N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-nitrobenzyl)-1-(pyridin-4-yl)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.