N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide
TL;DR: N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide (CAS 6154-01-4) is a chemical compound with molecular formula C17H14N4O3 and molecular weight 322.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide
Also Known As: N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide, BAS 02231176, 4-Nitro-N-(5-m-tolyl-2H-pyrazol-3-yl)-benzamide, N-[3-(3-methylphenyl)-1H-pyrazol-5-yl]-4-nitrobenzamide, Cambridge id 6154014
| Molecular Formula | C17H14N4O3 |
|---|---|
| Molecular Weight | 322.11 g/mol |
| LogP | 3.54562 |
| Topological Polar Surface Area | 100.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1066 |
| Heavy Atoms | 24 |
| Complexity | 900.2089 |
Chemical Identifiers
| CAS Number | 6154-01-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=CC(=NN2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide (CAS 6154-01-4), with molecular formula C17H14N4O3 and molecular weight 322.11 g/mol. IUPAC: N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide.
Chemical Property Profile of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide
Property Insights of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide
The XLogP value of 3.54562 indicates that N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide. Following Lipinski's Rule of Five, N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide has 2 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-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide?
The CAS number of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide is 6154-01-4.
What is the molecular formula of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide?
The molecular formula of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide is C17H14N4O3.
What is the molecular weight of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide?
The molecular weight of N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide is 322.11 g/mol.
Where can I buy N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide?
You can request a quote for N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.