4-nitro-N-(pyridin-2-ylmethyl)benzamide
TL;DR: 4-nitro-N-(pyridin-2-ylmethyl)benzamide (CAS 53865-18-2) is a chemical compound with molecular formula C13H11N3O3 and molecular weight 257.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-(pyridin-2-ylmethyl)benzamide
Also Known As: 4-nitro-N-(pyridin-2-ylmethyl)benzamide, Maybridge1_003366, 4-nitro-N-(2-pyridinylmethyl)benzamide, benzamide, 4-nitro-n-(2-pyridinylmethyl)-, BIM-0019205.P001
| Molecular Formula | C13H11N3O3 |
|---|---|
| Molecular Weight | 257.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 87.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.08005 |
| Heavy Atoms | 19 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 53865-18-2 |
|---|---|
| SMILES | C1=CC=NC(=C1)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | DWCCZVGNMVCAKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-nitro-N-(pyridin-2-ylmethyl)benzamide (CAS 53865-18-2), with molecular formula C13H11N3O3 and molecular weight 257.08 g/mol. IUPAC: 4-nitro-N-(pyridin-2-ylmethyl)benzamide.
Chemical Property Profile of 4-nitro-N-(pyridin-2-ylmethyl)benzamide
Property Insights of 4-nitro-N-(pyridin-2-ylmethyl)benzamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitro-N-(pyridin-2-ylmethyl)benzamide. The TPSA of 87.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N-(pyridin-2-ylmethyl)benzamide. Following Lipinski's Rule of Five, 4-nitro-N-(pyridin-2-ylmethyl)benzamide 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 4-nitro-N-(pyridin-2-ylmethyl)benzamide?
The CAS number of 4-nitro-N-(pyridin-2-ylmethyl)benzamide is 53865-18-2.
What is the molecular formula of 4-nitro-N-(pyridin-2-ylmethyl)benzamide?
The molecular formula of 4-nitro-N-(pyridin-2-ylmethyl)benzamide is C13H11N3O3.
What is the molecular weight of 4-nitro-N-(pyridin-2-ylmethyl)benzamide?
The molecular weight of 4-nitro-N-(pyridin-2-ylmethyl)benzamide is 257.08 g/mol.
Where can I buy 4-nitro-N-(pyridin-2-ylmethyl)benzamide?
You can request a quote for 4-nitro-N-(pyridin-2-ylmethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-N-(pyridin-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N-(pyridin-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.