2-(Trifluoromethyl)pyrimidin-4-amine
TL;DR: 2-(Trifluoromethyl)pyrimidin-4-amine (CAS 77883-76-2) 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.
2-(trifluoromethyl)pyrimidin-4-amine
Also Known As: 2-(trifluoromethyl)pyrimidin-4-amine, 2-TRIFLUOROMETHYL-4-AMINOPYRIMIDINE, 4-Amino-2-(trifluoromethyl)pyrimidine, 2-(trifluoromethyl)-4-Pyrimidinamine, 2-Trifluoromethyl-pyrimidin-4-ylamine
| 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 | 77883-76-2 |
|---|---|
| SMILES | C1=CN=C(N=C1N)C(F)(F)F |
| InChIKey | XJHPDOAHPIXTPH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Trifluoromethyl)pyrimidin-4-amine (CAS 77883-76-2), with molecular formula C5H4F3N3 and molecular weight 163.04 g/mol. IUPAC: 2-(trifluoromethyl)pyrimidin-4-amine.
Chemical Property Profile of 2-(Trifluoromethyl)pyrimidin-4-amine
Property Insights of 2-(Trifluoromethyl)pyrimidin-4-amine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Trifluoromethyl)pyrimidin-4-amine. With a topological polar surface area (TPSA) of 51.8 Ų, 2-(Trifluoromethyl)pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Trifluoromethyl)pyrimidin-4-amine 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-(Trifluoromethyl)pyrimidin-4-amine?
The CAS number of 2-(Trifluoromethyl)pyrimidin-4-amine is 77883-76-2.
What is the molecular formula of 2-(Trifluoromethyl)pyrimidin-4-amine?
The molecular formula of 2-(Trifluoromethyl)pyrimidin-4-amine is C5H4F3N3.
What is the molecular weight of 2-(Trifluoromethyl)pyrimidin-4-amine?
The molecular weight of 2-(Trifluoromethyl)pyrimidin-4-amine is 163.04 g/mol.
Where can I buy 2-(Trifluoromethyl)pyrimidin-4-amine?
You can request a quote for 2-(Trifluoromethyl)pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Trifluoromethyl)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Trifluoromethyl)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.