![N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide structure](/static/products/5255/525577-39-3.webp)
N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide
TL;DR: N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide (CAS 525577-39-3) is a chemical compound with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-3-nitrobenzamide
Also Known As: N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide, N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-3-nitrobenzamide, N-[(1-ethyl-3-methylpyrazol-4-yl)methyl](3-nitrophenyl)carboxamide
| Molecular Formula | C14H16N4O3 |
|---|---|
| Molecular Weight | 288.12 g/mol |
| LogP | 2.04962 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.12225 |
| Heavy Atoms | 21 |
| Complexity | 678.6087 |
Chemical Identifiers
| CAS Number | 525577-39-3 |
|---|---|
| SMILES | CCN1C=C(C(=N1)C)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide (CAS 525577-39-3), with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol. IUPAC: N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-3-nitrobenzamide.
Chemical Property Profile of N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide
Property Insights of N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide
The XLogP value of 2.04962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide has 1 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-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide?
The CAS number of N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide is 525577-39-3.
What is the molecular formula of N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide?
The molecular formula of N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide is C14H16N4O3.
What is the molecular weight of N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide?
The molecular weight of N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide is 288.12 g/mol.
Where can I buy N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide?
You can request a quote for N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.