N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide
TL;DR: N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide (CAS 299965-10-9) is a chemical compound with molecular formula C14H10N4O7 and molecular weight 346.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide
Also Known As: N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide, 3,5-dinitro-N-{3-nitro-4-methylphenyl}benzamide, AN-329/40098083, (3,5-dinitrophenyl)-N-(4-methyl-3-nitrophenyl)carboxamide
| Molecular Formula | C14H10N4O7 |
|---|---|
| Molecular Weight | 346.05 g/mol |
| LogP | 2.97192 |
| Topological Polar Surface Area | 158.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.05496 |
| Heavy Atoms | 25 |
| Complexity | 877.7984 |
Chemical Identifiers
| CAS Number | 299965-10-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide (CAS 299965-10-9), with molecular formula C14H10N4O7 and molecular weight 346.05 g/mol. IUPAC: N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide.
Chemical Property Profile of N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide
Property Insights of N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide
The XLogP value of 2.97192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide. The TPSA of 158.52 Ų indicates high polarity, suggesting N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide 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 N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide?
The CAS number of N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide is 299965-10-9.
What is the molecular formula of N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide?
The molecular formula of N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide is C14H10N4O7.
What is the molecular weight of N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide?
The molecular weight of N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide is 346.05 g/mol.
Where can I buy N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide?
You can request a quote for N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methyl-3-nitrophenyl)-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.