1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide
TL;DR: 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide (CAS 1003454-49-6) is a chemical compound with molecular formula C23H26N4O4 and molecular weight 422.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)pyrazole-3-carboxamide
Also Known As: 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide, 1-(2,3-dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)pyrazole-3-carboxamide
| Molecular Formula | C23H26N4O4 |
|---|---|
| Molecular Weight | 422.20 g/mol |
| LogP | 4.88386 |
| Topological Polar Surface Area | 99.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.1954 |
| Heavy Atoms | 31 |
| Complexity | 1134.6003 |
Chemical Identifiers
| CAS Number | 1003454-49-6 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2C(=C(C(=N2)C(=O)NCC(C)C)C)OC3=CC=CC=C3[N+](=O)[O-])C |
Product Overview
1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide (CAS 1003454-49-6), with molecular formula C23H26N4O4 and molecular weight 422.20 g/mol. IUPAC: 1-(2,3-dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)pyrazole-3-carboxamide.
Chemical Property Profile of 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide
Property Insights of 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide
The XLogP value of 4.88386 indicates that 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide has 1 hydrogen bond donor(s) and 5 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-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide?
The CAS number of 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide is 1003454-49-6.
What is the molecular formula of 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide?
The molecular formula of 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide is C23H26N4O4.
What is the molecular weight of 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide?
The molecular weight of 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide is 422.20 g/mol.
Where can I buy 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide?
You can request a quote for 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-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 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-1H-pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.