N-(2-Isopropylphenyl)-2-nitrobenzamide
TL;DR: N-(2-Isopropylphenyl)-2-nitrobenzamide (CAS 102630-99-9) is a chemical compound with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-N-(2-propan-2-ylphenyl)benzamide
Also Known As: N-(2-Isopropylphenyl)-2-nitrobenzamide, 2-nitro-N-(2-propan-2-ylphenyl)benzamide, 2-nitro-N-[2-(propan-2-yl)phenyl]benzamide, N-[2-(methylethyl)phenyl](2-nitrophenyl)carboxamide, 657-437-0
| Molecular Formula | C16H16N2O3 |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.1161 |
| Heavy Atoms | 21 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 102630-99-9 |
|---|---|
| SMILES | CC(C)C1=CC=CC=C1NC(=O)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | XKPRGOSIXUZKAC-UHFFFAOYSA-N |
Product Overview
N-(2-Isopropylphenyl)-2-nitrobenzamide (CAS 102630-99-9), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: 2-nitro-N-(2-propan-2-ylphenyl)benzamide.
Chemical Property Profile of N-(2-Isopropylphenyl)-2-nitrobenzamide
Property Insights of N-(2-Isopropylphenyl)-2-nitrobenzamide
The XLogP value of 3.7 indicates that N-(2-Isopropylphenyl)-2-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Isopropylphenyl)-2-nitrobenzamide. Following Lipinski's Rule of Five, N-(2-Isopropylphenyl)-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 N-(2-Isopropylphenyl)-2-nitrobenzamide?
The CAS number of N-(2-Isopropylphenyl)-2-nitrobenzamide is 102630-99-9.
What is the molecular formula of N-(2-Isopropylphenyl)-2-nitrobenzamide?
The molecular formula of N-(2-Isopropylphenyl)-2-nitrobenzamide is C16H16N2O3.
What is the molecular weight of N-(2-Isopropylphenyl)-2-nitrobenzamide?
The molecular weight of N-(2-Isopropylphenyl)-2-nitrobenzamide is 284.12 g/mol.
Where can I buy N-(2-Isopropylphenyl)-2-nitrobenzamide?
You can request a quote for N-(2-Isopropylphenyl)-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Isopropylphenyl)-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Isopropylphenyl)-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.