N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide
TL;DR: N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide (CAS 346447-52-7) is a chemical compound with molecular formula C18H15N5O5 and molecular weight 381.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3,5-dinitrobenzamide
Also Known As: N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide, N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3,5-dinitrobenzamide
| Molecular Formula | C18H15N5O5 |
|---|---|
| Molecular Weight | 381.11 g/mol |
| LogP | 3.55784 |
| Topological Polar Surface Area | 133.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.10733 |
| Heavy Atoms | 28 |
| Complexity | 1058.9958 |
Chemical Identifiers
| CAS Number | 346447-52-7 |
|---|---|
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide (CAS 346447-52-7), with molecular formula C18H15N5O5 and molecular weight 381.11 g/mol. IUPAC: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3,5-dinitrobenzamide.
Chemical Property Profile of N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide
Property Insights of N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide
The XLogP value of 3.55784 indicates that N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide. Following Lipinski's Rule of Five, N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide has 1 hydrogen bond donor(s) and 6 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-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide?
The CAS number of N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide is 346447-52-7.
What is the molecular formula of N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide?
The molecular formula of N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide is C18H15N5O5.
What is the molecular weight of N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide?
The molecular weight of N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide is 381.11 g/mol.
Where can I buy N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide?
You can request a quote for N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.