3-Amino-2-methyl-5-nitrobenzamide
TL;DR: 3-Amino-2-methyl-5-nitrobenzamide (CAS 3572-44-9) is a chemical compound with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-methyl-5-nitrobenzamide
Also Known As: Anot, 3-Amino-2-methyl-5-nitrobenzamide, 3-Amino-5-nitro-o-toluamide, 3-ANOT, ANOT [MI]
| Molecular Formula | C8H9N3O3 |
|---|---|
| Molecular Weight | 195.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.06439 |
| Heavy Atoms | 14 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 3572-44-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1N)[N+](=O)[O-])C(=O)N |
| InChIKey | RBLRQBGOUCRKRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-2-methyl-5-nitrobenzamide (CAS 3572-44-9), with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol. IUPAC: 3-amino-2-methyl-5-nitrobenzamide.
Chemical Property Profile of 3-Amino-2-methyl-5-nitrobenzamide
Property Insights of 3-Amino-2-methyl-5-nitrobenzamide
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-2-methyl-5-nitrobenzamide. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-2-methyl-5-nitrobenzamide. Following Lipinski's Rule of Five, 3-Amino-2-methyl-5-nitrobenzamide has 2 hydrogen bond donor(s) and 4 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-Amino-2-methyl-5-nitrobenzamide?
The CAS number of 3-Amino-2-methyl-5-nitrobenzamide is 3572-44-9.
What is the molecular formula of 3-Amino-2-methyl-5-nitrobenzamide?
The molecular formula of 3-Amino-2-methyl-5-nitrobenzamide is C8H9N3O3.
What is the molecular weight of 3-Amino-2-methyl-5-nitrobenzamide?
The molecular weight of 3-Amino-2-methyl-5-nitrobenzamide is 195.06 g/mol.
Where can I buy 3-Amino-2-methyl-5-nitrobenzamide?
You can request a quote for 3-Amino-2-methyl-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-2-methyl-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-2-methyl-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.