N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide
TL;DR: N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide (CAS 299405-90-6) is a chemical compound with molecular formula C14H15BrN4O3 and molecular weight 366.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-methylacetamide
Also Known As: BAS 00318322, N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide, N-benzyl-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-methylacetamide, N-Benzyl-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-methyl-acetamide
| Molecular Formula | C14H15BrN4O3 |
|---|---|
| Molecular Weight | 366.03 g/mol |
| LogP | 2.52082 |
| Topological Polar Surface Area | 81.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.03275 |
| Heavy Atoms | 22 |
| Complexity | 699.6135 |
Chemical Identifiers
| CAS Number | 299405-90-6 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)N(C)CC2=CC=CC=C2)[N+](=O)[O-])Br |
Product Overview
N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide (CAS 299405-90-6), with molecular formula C14H15BrN4O3 and molecular weight 366.03 g/mol. IUPAC: N-benzyl-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-methylacetamide.
Chemical Property Profile of N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide
Property Insights of N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide
The XLogP value of 2.52082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide. The TPSA of 81.27 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide. Following Lipinski's Rule of Five, N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide has 0 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 N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
The CAS number of N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide is 299405-90-6.
What is the molecular formula of N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
The molecular formula of N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide is C14H15BrN4O3.
What is the molecular weight of N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
The molecular weight of N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide is 366.03 g/mol.
Where can I buy N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
You can request a quote for N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.