N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide
TL;DR: N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide (CAS 404853-19-6) is a chemical compound with molecular formula C11H14N6O3 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-methyl-4-nitropyrazole-5-carboxamide
Also Known As: BAS 03352315, N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide, N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-1-methyl-4-nitro-1H-pyrazole-5-carboxamide, N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitro-1-methyl-1H-pyrazole-5-carboxamide, Cambridge id 6508068
| Molecular Formula | C11H14N6O3 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.11273 |
| Heavy Atoms | 20 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 404853-19-6 |
|---|---|
| SMILES | CC1=C(C=NN1C)CNC(=O)C2=C(C=NN2C)[N+](=O)[O-] |
| InChIKey | XYBREHXBDKRBLP-UHFFFAOYSA-N |
Product Overview
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide (CAS 404853-19-6), with molecular formula C11H14N6O3 and molecular weight 278.11 g/mol. IUPAC: N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-methyl-4-nitropyrazole-5-carboxamide.
Chemical Property Profile of N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide
Property Insights of N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide
The XLogP value of -0.1 indicates that N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide 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 N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide?
The CAS number of N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide is 404853-19-6.
What is the molecular formula of N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide?
The molecular formula of N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide is C11H14N6O3.
What is the molecular weight of N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide?
The molecular weight of N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide is 278.11 g/mol.
Where can I buy N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide?
You can request a quote for N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.