2-Amino-4-(trifluoromethyl)pyrimidine
TL;DR: 2-Amino-4-(trifluoromethyl)pyrimidine (CAS 16075-42-6) is a chemical compound with molecular formula C5H4F3N3 and molecular weight 163.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(trifluoromethyl)pyrimidin-2-amine
Also Known As: 2-Amino-4-(trifluoromethyl)pyrimidine, 4-(trifluoromethyl)pyrimidin-2-amine, 2-Pyrimidinamine, 4-(trifluoromethyl)-, 2-amino-4-trifluoromethylpyrimidine, trifluoromethylpyrimidinamine
| Molecular Formula | C5H4F3N3 |
|---|---|
| Molecular Weight | 163.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.03574 |
| Heavy Atoms | 11 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 16075-42-6 |
|---|---|
| SMILES | C1=CN=C(N=C1C(F)(F)F)N |
| InChIKey | NKOTXYPTXKUCDL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Amino-4-(trifluoromethyl)pyrimidine (CAS 16075-42-6), with molecular formula C5H4F3N3 and molecular weight 163.04 g/mol. IUPAC: 4-(trifluoromethyl)pyrimidin-2-amine.
Chemical Property Profile of 2-Amino-4-(trifluoromethyl)pyrimidine
Property Insights of 2-Amino-4-(trifluoromethyl)pyrimidine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-4-(trifluoromethyl)pyrimidine. With a topological polar surface area (TPSA) of 51.8 Ų, 2-Amino-4-(trifluoromethyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Amino-4-(trifluoromethyl)pyrimidine has 1 hydrogen bond donor(s) and 6 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-Amino-4-(trifluoromethyl)pyrimidine?
The CAS number of 2-Amino-4-(trifluoromethyl)pyrimidine is 16075-42-6.
What is the molecular formula of 2-Amino-4-(trifluoromethyl)pyrimidine?
The molecular formula of 2-Amino-4-(trifluoromethyl)pyrimidine is C5H4F3N3.
What is the molecular weight of 2-Amino-4-(trifluoromethyl)pyrimidine?
The molecular weight of 2-Amino-4-(trifluoromethyl)pyrimidine is 163.04 g/mol.
Where can I buy 2-Amino-4-(trifluoromethyl)pyrimidine?
You can request a quote for 2-Amino-4-(trifluoromethyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-4-(trifluoromethyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-4-(trifluoromethyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.