1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide
TL;DR: 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide (CAS 514218-87-2) is a chemical compound with molecular formula C15H12N4O3 and molecular weight 296.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide
Also Known As: 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide, 1-methyl-N-(naphthalen-2-yl)-4-nitro-1H-pyrazole-3-carboxamide, (1-methyl-4-nitropyrazol-3-yl)-N-(2-naphthyl)carboxamide, 4-nitro-1-methyl-N-(2-naphthyl)-1H-pyrazole-3-carboxamide, 1-METHYL-N-(2-NAPHTHYL)-4-NITRO-1H-PYRAZOLE-3-CARBOXAMIDE
| Molecular Formula | C15H12N4O3 |
|---|---|
| Molecular Weight | 296.09 g/mol |
| LogP | 2.7338 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.09094 |
| Heavy Atoms | 22 |
| Complexity | 885.3799 |
Chemical Identifiers
| CAS Number | 514218-87-2 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)NC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-] |
Product Overview
1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide (CAS 514218-87-2), with molecular formula C15H12N4O3 and molecular weight 296.09 g/mol. IUPAC: 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide.
Chemical Property Profile of 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide
Property Insights of 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide
The XLogP value of 2.7338 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide. Following Lipinski's Rule of Five, 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-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 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide?
The CAS number of 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide is 514218-87-2.
What is the molecular formula of 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide?
The molecular formula of 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide is C15H12N4O3.
What is the molecular weight of 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide?
The molecular weight of 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide is 296.09 g/mol.
Where can I buy 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide?
You can request a quote for 1-methyl-N-naphthalen-2-yl-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 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-N-naphthalen-2-yl-4-nitropyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.