2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide
TL;DR: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide (CAS 492422-23-8) is a chemical compound with molecular formula C13H13IN4O3 and molecular weight 400.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide
Also Known As: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide, 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(2-iodophenyl)acetamide, 2-{4-nitro-3,5-dimethyl-1H-pyrazol-1-yl}-N-(2-iodophenyl)acetamide
| Molecular Formula | C13H13IN4O3 |
|---|---|
| Molecular Weight | 400.00 g/mol |
| LogP | 2.65144 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.00323 |
| Heavy Atoms | 21 |
| Complexity | 711.4371 |
Chemical Identifiers
| CAS Number | 492422-23-8 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2I)C)[N+](=O)[O-] |
Product Overview
2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide (CAS 492422-23-8), with molecular formula C13H13IN4O3 and molecular weight 400.00 g/mol. IUPAC: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide.
Chemical Property Profile of 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide
Property Insights of 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide
The XLogP value of 2.65144 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide. Following Lipinski's Rule of Five, 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide has 1 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 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide?
The CAS number of 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide is 492422-23-8.
What is the molecular formula of 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide?
The molecular formula of 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide is C13H13IN4O3.
What is the molecular weight of 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide?
The molecular weight of 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide is 400.00 g/mol.
Where can I buy 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide?
You can request a quote for 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-iodophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.