3,5-dinitro-N-(3-nitrophenyl)benzamide
TL;DR: 3,5-dinitro-N-(3-nitrophenyl)benzamide (CAS 36360-17-5) is a chemical compound with molecular formula C13H8N4O7 and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dinitro-N-(3-nitrophenyl)benzamide
Also Known As: 3,5-dinitro-N-(3-nitrophenyl)benzamide, 3,3',5-trinitrobenzanilide, BAS 00203657, Benzamide, 3,5-dinitro-N-(3-nitrophenyl)-, 3,5-Dinitro-N-(3-nitro-phenyl)-benzamide
| Molecular Formula | C13H8N4O7 |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 2.6635 |
| Topological Polar Surface Area | 158.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.0393 |
| Heavy Atoms | 24 |
| Complexity | 832.89874 |
Chemical Identifiers
| CAS Number | 36360-17-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
3,5-dinitro-N-(3-nitrophenyl)benzamide (CAS 36360-17-5), with molecular formula C13H8N4O7 and molecular weight 332.04 g/mol. IUPAC: 3,5-dinitro-N-(3-nitrophenyl)benzamide.
Chemical Property Profile of 3,5-dinitro-N-(3-nitrophenyl)benzamide
Property Insights of 3,5-dinitro-N-(3-nitrophenyl)benzamide
The XLogP value of 2.6635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-dinitro-N-(3-nitrophenyl)benzamide. The TPSA of 158.52 Ų indicates high polarity, suggesting 3,5-dinitro-N-(3-nitrophenyl)benzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5-dinitro-N-(3-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 7 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 3,5-dinitro-N-(3-nitrophenyl)benzamide?
The CAS number of 3,5-dinitro-N-(3-nitrophenyl)benzamide is 36360-17-5.
What is the molecular formula of 3,5-dinitro-N-(3-nitrophenyl)benzamide?
The molecular formula of 3,5-dinitro-N-(3-nitrophenyl)benzamide is C13H8N4O7.
What is the molecular weight of 3,5-dinitro-N-(3-nitrophenyl)benzamide?
The molecular weight of 3,5-dinitro-N-(3-nitrophenyl)benzamide is 332.04 g/mol.
Where can I buy 3,5-dinitro-N-(3-nitrophenyl)benzamide?
You can request a quote for 3,5-dinitro-N-(3-nitrophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dinitro-N-(3-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dinitro-N-(3-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.