4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine
TL;DR: 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine (CAS 5734-63-4) is a chemical compound with molecular formula C6H6F3N3 and molecular weight 177.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-6-(trifluoromethyl)pyrimidin-2-amine
Also Known As: 4-methyl-6-(trifluoromethyl)pyrimidin-2-amine, 2qfo, HSP90 Inhibitor, 2, 4-methyl-6-(trifluoromethyl)-2-pyrimidinamine, TimTec1_005036
| Molecular Formula | C6H6F3N3 |
|---|---|
| Molecular Weight | 177.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.05138 |
| Heavy Atoms | 12 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 5734-63-4 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N)C(F)(F)F |
| InChIKey | CNTCLEOUAMWZGS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine (CAS 5734-63-4), with molecular formula C6H6F3N3 and molecular weight 177.05 g/mol. IUPAC: 4-methyl-6-(trifluoromethyl)pyrimidin-2-amine.
Chemical Property Profile of 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine
Property Insights of 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine. With a topological polar surface area (TPSA) of 51.8 Ų, 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine 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 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine?
The CAS number of 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine is 5734-63-4.
What is the molecular formula of 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine?
The molecular formula of 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine is C6H6F3N3.
What is the molecular weight of 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine?
The molecular weight of 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine is 177.05 g/mol.
Where can I buy 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine?
You can request a quote for 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-6-(trifluoromethyl)-2-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.