2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide
TL;DR: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide (CAS 353455-58-0) is a chemical compound with molecular formula C11H11BrN4O3S and molecular weight 357.97 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-(thiophen-2-ylmethyl)acetamide
Also Known As: BAS 00414810, 2-(4-Bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-thiophen-2-ylmethyl-acetamide, 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide, 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide, 2-(4-BROMO-5-METHYL-3-NITRO-1H-PYRAZOL-1-YL)-N-[(THIOPHEN-2-YL)METHYL]ACETAMIDE
| Molecular Formula | C11H11BrN4O3S |
|---|---|
| Molecular Weight | 357.97 g/mol |
| LogP | 2.24012 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 357.9735 |
| Heavy Atoms | 20 |
| Complexity | 638.389 |
Chemical Identifiers
| CAS Number | 353455-58-0 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NCC2=CC=CS2)[N+](=O)[O-])Br |
Product Overview
2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide (CAS 353455-58-0), with molecular formula C11H11BrN4O3S and molecular weight 357.97 g/mol. IUPAC: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide.
Chemical Property Profile of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide
Property Insights of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide
The XLogP value of 2.24012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide. Following Lipinski's Rule of Five, 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide has 1 hydrogen bond donor(s) and 5 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-(thiophen-2-ylmethyl)acetamide?
The CAS number of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide is 353455-58-0.
What is the molecular formula of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide?
The molecular formula of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide is C11H11BrN4O3S.
What is the molecular weight of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide?
The molecular weight of 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide is 357.97 g/mol.
Where can I buy 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide?
You can request a quote for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)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-(thiophen-2-ylmethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.