N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide
TL;DR: N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide (CAS 1001567-66-3) is a chemical compound with molecular formula C13H12BrN3O2 and molecular weight 321.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetylphenyl)-4-bromo-1-methylpyrazole-5-carboxamide
Also Known As: N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide, N-(4-acetylphenyl)-4-bromo-2-methylpyrazole-3-carboxamide, 4-Bromo-2-methyl-2H-pyrazole-3-carboxylic acid (4-acetyl-phenyl)-amide, N-(4-acetylphenyl)(4-bromo-1-methylpyrazol-5-yl)carboxamide, 4-bromo-2-methyl-2h-pyrazole-3-carboxylic acid(4-acetyl-phenyl)-amide
| Molecular Formula | C13H12BrN3O2 |
|---|---|
| Molecular Weight | 321.01 g/mol |
| LogP | 2.6375 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.0113 |
| Heavy Atoms | 19 |
| Complexity | 612.33795 |
Chemical Identifiers
| CAS Number | 1001567-66-3 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=NN2C)Br |
Product Overview
N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide (CAS 1001567-66-3), with molecular formula C13H12BrN3O2 and molecular weight 321.01 g/mol. IUPAC: N-(4-acetylphenyl)-4-bromo-1-methylpyrazole-5-carboxamide.
Chemical Property Profile of N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide
Property Insights of N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide
The XLogP value of 2.6375 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide has 1 hydrogen bond donor(s) and 3 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 N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide?
The CAS number of N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide is 1001567-66-3.
What is the molecular formula of N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide?
The molecular formula of N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide is C13H12BrN3O2.
What is the molecular weight of N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide?
The molecular weight of N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide is 321.01 g/mol.
Where can I buy N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide?
You can request a quote for N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-acetylphenyl)-4-bromo-1-methyl-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.