4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline
TL;DR: 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline (CAS 956263-23-3) is a chemical compound with molecular formula C16H12F3N3 and molecular weight 303.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-phenyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
Also Known As: ZERO/005223, 4-[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline, 4-(1-Phenyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)aniline, 4-[1-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]aniline, 4-[1-phenyl-3-(trifluoromethyl)pyrazol-5-yl]phenylamine
| Molecular Formula | C16H12F3N3 |
|---|---|
| Molecular Weight | 303.10 g/mol |
| LogP | 4.1403 |
| Topological Polar Surface Area | 43.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.09833 |
| Heavy Atoms | 22 |
| Complexity | 774.64575 |
Chemical Identifiers
| CAS Number | 956263-23-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)N |
Product Overview
4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline (CAS 956263-23-3), with molecular formula C16H12F3N3 and molecular weight 303.10 g/mol. IUPAC: 4-[1-phenyl-3-(trifluoromethyl)pyrazol-5-yl]aniline.
Chemical Property Profile of 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline
Property Insights of 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline
The XLogP value of 4.1403 indicates that 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.84 Ų, 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline has 1 hydrogen bond donor(s) and 2 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 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline?
The CAS number of 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline is 956263-23-3.
What is the molecular formula of 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline?
The molecular formula of 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline is C16H12F3N3.
What is the molecular weight of 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline?
The molecular weight of 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline is 303.10 g/mol.
Where can I buy 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline?
You can request a quote for 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-Phenyl-5-(trifluoromethyl)pyrazol-3-yl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.