3-nitro-N-{4-nitrophenyl}-2-methylbenzamide
TL;DR: 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide (CAS 346723-61-3) is a chemical compound with molecular formula C14H11N3O5 and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-nitro-N-(4-nitrophenyl)benzamide
Also Known As: 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide, 2-methyl-3-nitro-N-(4-nitrophenyl)benzamide, (2-methyl-3-nitrophenyl)-N-(4-nitrophenyl)carboxamide
| Molecular Formula | C14H11N3O5 |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | 3.06372 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.0699 |
| Heavy Atoms | 22 |
| Complexity | 755.57367 |
Chemical Identifiers
| CAS Number | 346723-61-3 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
3-nitro-N-{4-nitrophenyl}-2-methylbenzamide (CAS 346723-61-3), with molecular formula C14H11N3O5 and molecular weight 301.07 g/mol. IUPAC: 2-methyl-3-nitro-N-(4-nitrophenyl)benzamide.
Chemical Property Profile of 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide
Property Insights of 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide
The XLogP value of 3.06372 indicates that 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide 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 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide. Following Lipinski's Rule of Five, 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide 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 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide?
The CAS number of 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide is 346723-61-3.
What is the molecular formula of 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide?
The molecular formula of 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide is C14H11N3O5.
What is the molecular weight of 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide?
The molecular weight of 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide is 301.07 g/mol.
Where can I buy 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide?
You can request a quote for 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-N-{4-nitrophenyl}-2-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.