![2-[4-(trifluoromethyl)phenyl]-1H-perimidine structure](/static/products/7601/76019-83-5.webp)
2-[4-(trifluoromethyl)phenyl]-1H-perimidine
TL;DR: 2-[4-(trifluoromethyl)phenyl]-1H-perimidine (CAS 76019-83-5) is a chemical compound with molecular formula C18H11F3N2 and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(trifluoromethyl)phenyl]-1H-perimidine
Also Known As: 2-[4-(trifluoromethyl)phenyl]-1H-perimidine, 2-(4-Trifluoromethylphenyl)-1H-perimidine, 3H-Pyrazol-3-one,5-amino-1,2-dihydro-1,4-dimethyl-2-phenyl
| Molecular Formula | C18H11F3N2 |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.08743 |
| Heavy Atoms | 23 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 76019-83-5 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)NC(=NC3=CC=C2)C4=CC=C(C=C4)C(F)(F)F |
| InChIKey | AXWOSANQDLZOFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[4-(trifluoromethyl)phenyl]-1H-perimidine (CAS 76019-83-5), with molecular formula C18H11F3N2 and molecular weight 312.09 g/mol. IUPAC: 2-[4-(trifluoromethyl)phenyl]-1H-perimidine.
Chemical Property Profile of 2-[4-(trifluoromethyl)phenyl]-1H-perimidine
Property Insights of 2-[4-(trifluoromethyl)phenyl]-1H-perimidine
The XLogP value of 4.6 indicates that 2-[4-(trifluoromethyl)phenyl]-1H-perimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.4 Ų, 2-[4-(trifluoromethyl)phenyl]-1H-perimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(trifluoromethyl)phenyl]-1H-perimidine 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 2-[4-(trifluoromethyl)phenyl]-1H-perimidine?
The CAS number of 2-[4-(trifluoromethyl)phenyl]-1H-perimidine is 76019-83-5.
What is the molecular formula of 2-[4-(trifluoromethyl)phenyl]-1H-perimidine?
The molecular formula of 2-[4-(trifluoromethyl)phenyl]-1H-perimidine is C18H11F3N2.
What is the molecular weight of 2-[4-(trifluoromethyl)phenyl]-1H-perimidine?
The molecular weight of 2-[4-(trifluoromethyl)phenyl]-1H-perimidine is 312.09 g/mol.
Where can I buy 2-[4-(trifluoromethyl)phenyl]-1H-perimidine?
You can request a quote for 2-[4-(trifluoromethyl)phenyl]-1H-perimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(trifluoromethyl)phenyl]-1H-perimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(trifluoromethyl)phenyl]-1H-perimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.