4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide
TL;DR: 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide (CAS 333346-92-2) is a chemical compound with molecular formula C15H13ClN2O3 and molecular weight 304.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(4-methylphenyl)methyl]-2-nitrobenzamide
Also Known As: 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide, 4-chloro-2-nitro-N-(4-methylbenzyl)benzamide, 4-chloro-N-[(4-methylphenyl)methyl]-2-nitrobenzamide, (4-chloro-2-nitrophenyl)-N-[(4-methylphenyl)methyl]carboxamide
| Molecular Formula | C15H13ClN2O3 |
|---|---|
| Molecular Weight | 304.06 g/mol |
| LogP | 3.48662 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.06146 |
| Heavy Atoms | 21 |
| Complexity | 683.8181 |
Chemical Identifiers
| CAS Number | 333346-92-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide (CAS 333346-92-2), with molecular formula C15H13ClN2O3 and molecular weight 304.06 g/mol. IUPAC: 4-chloro-N-[(4-methylphenyl)methyl]-2-nitrobenzamide.
Chemical Property Profile of 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide
Property Insights of 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide
The XLogP value of 3.48662 indicates that 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide. Following Lipinski's Rule of Five, 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide has 1 hydrogen bond donor(s) and 3 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-chloro-N-(4-methylbenzyl)-2-nitrobenzamide?
The CAS number of 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide is 333346-92-2.
What is the molecular formula of 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide?
The molecular formula of 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide is C15H13ClN2O3.
What is the molecular weight of 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide?
The molecular weight of 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide is 304.06 g/mol.
Where can I buy 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide?
You can request a quote for 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(4-methylbenzyl)-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.