4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile
TL;DR: 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile (CAS 374102-19-9) is a chemical compound with molecular formula C14H11F3N4O and molecular weight 308.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile
Also Known As: BIM-0029872.P001, AB00095256-01, 4-(4-methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile, 4-((4-methoxyphenyl)amino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile, 4-(4-Methoxy-phenylamino)-6-methyl-2-trifluoromethyl-pyrimidine-5-carbonitrile
| Molecular Formula | C14H11F3N4O |
|---|---|
| Molecular Weight | 308.09 g/mol |
| LogP | 3.4277 |
| Topological Polar Surface Area | 70.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.0885 |
| Heavy Atoms | 22 |
| Complexity | 720.5934 |
Chemical Identifiers
| CAS Number | 374102-19-9 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)C(F)(F)F)NC2=CC=C(C=C2)OC)C#N |
Product Overview
4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile (CAS 374102-19-9), with molecular formula C14H11F3N4O and molecular weight 308.09 g/mol. IUPAC: 4-(4-methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile.
Chemical Property Profile of 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile
Property Insights of 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile
The XLogP value of 3.4277 indicates that 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile. Following Lipinski's Rule of Five, 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile has 1 hydrogen bond donor(s) and 5 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-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile?
The CAS number of 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile is 374102-19-9.
What is the molecular formula of 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile?
The molecular formula of 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile is C14H11F3N4O.
What is the molecular weight of 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile?
The molecular weight of 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile is 308.09 g/mol.
Where can I buy 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile?
You can request a quote for 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxyanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.