2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide
TL;DR: 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide (CAS 378209-20-2) 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.
1-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-5-carboxamide
Also Known As: BAS 03224279, 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide, 2-Methyl-4-nitro-2H-pyrazole-3-carboxylic acid biphenyl-4-ylamide, (1-methyl-4-nitropyrazol-5-yl)-N-(4-phenylphenyl)carboxamide, N-(biphenyl-4-yl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
| Molecular Formula | C17H14N4O3 |
|---|---|
| Molecular Weight | 322.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.1066 |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 378209-20-2 |
|---|---|
| SMILES | CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3 |
| InChIKey | PKTHZCYRISYSSG-UHFFFAOYSA-N |
Product Overview
2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide (CAS 378209-20-2), with molecular formula C17H14N4O3 and molecular weight 322.11 g/mol. IUPAC: 1-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-5-carboxamide.
Chemical Property Profile of 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide
Property Insights of 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide 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 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide?
The CAS number of 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide is 378209-20-2.
What is the molecular formula of 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide?
The molecular formula of 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide is C17H14N4O3.
What is the molecular weight of 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide?
The molecular weight of 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide is 322.11 g/mol.
Where can I buy 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide?
You can request a quote for 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-4-nitro-N-(4-phenylphenyl)pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.