5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole
TL;DR: 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole (CAS 16459-45-3) is a chemical compound with molecular formula C10H10N4O2 and molecular weight 218.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-(2-nitrophenyl)pyrazol-3-amine
Also Known As: 5-methyl-2-(2-nitrophenyl)pyrazol-3-amine, J1.345.587B, 1H-Pyrazol-5-amine, 3-methyl-1-(2-nitrophenyl)-, 3-methyl-1-(2-nitrophenyl)-1H-pyrazol-5-amine, 2-(2-Nitrophenyl)-5-methyl-2H-pyrazole-3-amine
| Molecular Formula | C10H10N4O2 |
|---|---|
| Molecular Weight | 218.08 g/mol |
| LogP | 1.67112 |
| Topological Polar Surface Area | 86.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.08037 |
| Heavy Atoms | 16 |
| Complexity | 547.5021 |
Chemical Identifiers
| CAS Number | 16459-45-3 |
|---|---|
| SMILES | CC1=NN(C(=C1)N)C2=CC=CC=C2[N+](=O)[O-] |
Product Overview
5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole (CAS 16459-45-3), with molecular formula C10H10N4O2 and molecular weight 218.08 g/mol. IUPAC: 5-methyl-2-(2-nitrophenyl)pyrazol-3-amine.
Chemical Property Profile of 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole
Property Insights of 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole
The XLogP value of 1.67112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole. The TPSA of 86.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole. Following Lipinski's Rule of Five, 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole 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 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole?
The CAS number of 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole is 16459-45-3.
What is the molecular formula of 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole?
The molecular formula of 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole is C10H10N4O2.
What is the molecular weight of 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole?
The molecular weight of 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole is 218.08 g/mol.
Where can I buy 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole?
You can request a quote for 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-1-{2-nitrophenyl}-3-methyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.