3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine
TL;DR: 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine (CAS 852690-94-9) is a chemical compound with molecular formula C17H13F3N4O2 and molecular weight 362.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(4-nitrophenyl)-4-[3-(trifluoromethyl)phenyl]pyrazol-5-amine
Also Known As: 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine, 3-methyl-1-(4-nitrophenyl)-4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-ylamine, 3-Methyl-1-(4-nitrophenyl)-4-[3-(trifluoromethyl)-phenyl]-1H-pyrazol-5-ylamine, 5-methyl-2-(4-nitrophenyl)-4-[3-(trifluoromethyl)phenyl]pyrazol-3-amine, 3-Methyl-1-(4-nitrophenyl)-4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-amine
| Molecular Formula | C17H13F3N4O2 |
|---|---|
| Molecular Weight | 362.10 g/mol |
| LogP | 4.35692 |
| Topological Polar Surface Area | 86.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.09906 |
| Heavy Atoms | 26 |
| Complexity | 978.6633 |
Chemical Identifiers
| CAS Number | 852690-94-9 |
|---|---|
| SMILES | CC1=NN(C(=C1C2=CC(=CC=C2)C(F)(F)F)N)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine (CAS 852690-94-9), with molecular formula C17H13F3N4O2 and molecular weight 362.10 g/mol. IUPAC: 3-methyl-1-(4-nitrophenyl)-4-[3-(trifluoromethyl)phenyl]pyrazol-5-amine.
Chemical Property Profile of 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine
Property Insights of 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine
The XLogP value of 4.35692 indicates that 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine. Following Lipinski's Rule of Five, 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine 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 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine?
The CAS number of 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine is 852690-94-9.
What is the molecular formula of 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine?
The molecular formula of 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine is C17H13F3N4O2.
What is the molecular weight of 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine?
The molecular weight of 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine is 362.10 g/mol.
Where can I buy 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine?
You can request a quote for 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-(4-nitrophenyl)-4-(3-(trifluoromethyl)phenyl)-1H-pyrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.