4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine
TL;DR: 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine (CAS 921230-79-7) is a chemical compound with molecular formula C6H4F3N3 and molecular weight 175.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylidene-2-(trifluoromethyl)pyrimidin-4-imine
Also Known As: 3-azulen-1-ylpyridine, 4-IMINO-5-METHIDYL-2-TRIFLUOROMETHYLPYRIMIDINE, 5-methylidene-2-(trifluoromethyl)pyrimidin-4-imine, 4-chloro-1,2,3-tridodecoxy-5-iodobenzene, 4-chloro-1,2,3-tridodecoxy-5-ethynylbenzene
| Molecular Formula | C6H4F3N3 |
|---|---|
| Molecular Weight | 175.04 g/mol |
| LogP | 1.56507 |
| Topological Polar Surface Area | 48.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.03574 |
| Heavy Atoms | 12 |
| Complexity | 297.6504 |
Chemical Identifiers
| CAS Number | 921230-79-7 |
|---|---|
| SMILES | C=C1C=NC(=NC1=N)C(F)(F)F |
Product Overview
4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine (CAS 921230-79-7), with molecular formula C6H4F3N3 and molecular weight 175.04 g/mol. IUPAC: 5-methylidene-2-(trifluoromethyl)pyrimidin-4-imine.
Chemical Property Profile of 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine
Property Insights of 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine
The XLogP value of 1.56507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine. With a topological polar surface area (TPSA) of 48.57 Ų, 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine 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-Imino-5-Methidyl-2-Trifluoromethylpyrimidine?
The CAS number of 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine is 921230-79-7.
What is the molecular formula of 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine?
The molecular formula of 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine is C6H4F3N3.
What is the molecular weight of 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine?
The molecular weight of 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine is 175.04 g/mol.
Where can I buy 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine?
You can request a quote for 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Imino-5-Methidyl-2-Trifluoromethylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.