4-Amino-3,5-dinitrobenzamide
TL;DR: 4-Amino-3,5-dinitrobenzamide (CAS 54321-79-8) is a chemical compound with molecular formula C7H6N4O5 and molecular weight 226.03381 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-3,5-dinitrobenzamide
Also Known As: 4-Amino-3,5-dinitrobenzamide, Benzamide, 4-amino-3,5-dinitro-, 3,5-dinitro-4-aMinobenzaMide, 4-amino-3,5-dinitro-benzamide, Benzamide,4-amino-3,5-dinitro-
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H6N4O5 |
| Molecular Weight | 226.03381 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.03381 Da |
| Heavy Atoms | 16 |
| Complexity | 298.0 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])C(=O)N |
| InChIKey | BNVZFENSTYWDDB-UHFFFAOYSA-N |
Chemical Property Profile of 4-Amino-3,5-dinitrobenzamide
Property Insights of 4-Amino-3,5-dinitrobenzamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-3,5-dinitrobenzamide. The TPSA of 161.0 Ų indicates high polarity, suggesting 4-Amino-3,5-dinitrobenzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Amino-3,5-dinitrobenzamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Amino-3,5-dinitrobenzamide?
The CAS number of 4-Amino-3,5-dinitrobenzamide is 54321-79-8.
What is the molecular formula of 4-Amino-3,5-dinitrobenzamide?
The molecular formula of 4-Amino-3,5-dinitrobenzamide is C7H6N4O5.
What is the molecular weight of 4-Amino-3,5-dinitrobenzamide?
The molecular weight of 4-Amino-3,5-dinitrobenzamide is 226.03381 g/mol.
Where can I buy 4-Amino-3,5-dinitrobenzamide?
You can request a quote for 4-Amino-3,5-dinitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Amino-3,5-dinitrobenzamide?
Yes, CoreyChem provides custom synthesis services for 4-Amino-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.