2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
TL;DR: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (CAS 355805-14-0) is a chemical compound with molecular formula C16H19BrN4O5 and molecular weight 426.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Also Known As: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide, 2-{4-bromo-3-nitro-5-methyl-1H-pyrazol-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide, 2-(4-BROMO-5-METHYL-3-NITRO-1H-PYRAZOL-1-YL)-N-(3,4-DIMETHOXYPHENETHYL)ACETAMIDE, 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide, 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
| Molecular Formula | C16H19BrN4O5 |
|---|---|
| Molecular Weight | 426.05 g/mol |
| LogP | 2.23832 |
| Topological Polar Surface Area | 108.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.0539 |
| Heavy Atoms | 26 |
| Complexity | 821.21173 |
Chemical Identifiers
| CAS Number | 355805-14-0 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NCCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-])Br |
Product Overview
2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (CAS 355805-14-0), with molecular formula C16H19BrN4O5 and molecular weight 426.05 g/mol. IUPAC: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide.
Chemical Property Profile of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Property Insights of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
The XLogP value of 2.23832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide. The TPSA of 108.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide. Following Lipinski's Rule of Five, 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide has 1 hydrogen bond donor(s) and 6 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-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide?
The CAS number of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide is 355805-14-0.
What is the molecular formula of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide?
The molecular formula of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide is C16H19BrN4O5.
What is the molecular weight of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide?
The molecular weight of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide is 426.05 g/mol.
Where can I buy 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide?
You can request a quote for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.