![2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide structure](/static/products/331/331435-65-5.png)
2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide
TL;DR: 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide (CAS 331435-65-5) is a chemical compound with molecular formula C16H15N3O5 and molecular weight 329.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-N-(4-propan-2-ylphenyl)benzamide
Also Known As: BAS 00407701, 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide, 2,4-dinitro-N-(4-propan-2-ylphenyl)benzamide, N-(4-Isopropyl-phenyl)-2,4-dinitro-benzamide
| Molecular Formula | C16H15N3O5 |
|---|---|
| Molecular Weight | 329.10 g/mol |
| LogP | 3.8787 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.10117 |
| Heavy Atoms | 24 |
| Complexity | 799.8602 |
Chemical Identifiers
| CAS Number | 331435-65-5 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide (CAS 331435-65-5), with molecular formula C16H15N3O5 and molecular weight 329.10 g/mol. IUPAC: 2,4-dinitro-N-(4-propan-2-ylphenyl)benzamide.
Chemical Property Profile of 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide
Property Insights of 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide
The XLogP value of 3.8787 indicates that 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide. Following Lipinski's Rule of Five, 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide has 1 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 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide?
The CAS number of 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide is 331435-65-5.
What is the molecular formula of 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide?
The molecular formula of 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide is C16H15N3O5.
What is the molecular weight of 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide?
The molecular weight of 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide is 329.10 g/mol.
Where can I buy 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide?
You can request a quote for 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dinitro-N-[4-(propan-2-yl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.