N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide
TL;DR: N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide (CAS 321534-63-8) is a chemical compound with molecular formula C11H10N4O3 and molecular weight 246.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-3-nitro-4-pyrazol-1-ylbenzamide
Also Known As: N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzamide, N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide, N-methyl-3-nitro-4-pyrazol-1-ylbenzamide, 2G-357S, N-methyl-3-nitro-4-pyrazol-1-yl-benzamide
| Molecular Formula | C11H10N4O3 |
|---|---|
| Molecular Weight | 246.08 g/mol |
| LogP | 1.1401 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.07529 |
| Heavy Atoms | 18 |
| Complexity | 592.3407 |
Chemical Identifiers
| CAS Number | 321534-63-8 |
|---|---|
| SMILES | CNC(=O)C1=CC(=C(C=C1)N2C=CC=N2)[N+](=O)[O-] |
Product Overview
N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide (CAS 321534-63-8), with molecular formula C11H10N4O3 and molecular weight 246.08 g/mol. IUPAC: N-methyl-3-nitro-4-pyrazol-1-ylbenzamide.
Chemical Property Profile of N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide
Property Insights of N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide
The XLogP value of 1.1401 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide. Following Lipinski's Rule of Five, N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide 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-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide?
The CAS number of N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide is 321534-63-8.
What is the molecular formula of N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide?
The molecular formula of N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide is C11H10N4O3.
What is the molecular weight of N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide?
The molecular weight of N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide is 246.08 g/mol.
Where can I buy N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide?
You can request a quote for N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-3-nitro-4-(1H-pyrazol-1-yl)benzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.