![1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine structure](/static/products/689/689747-97-5.png)
1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
TL;DR: 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine (CAS 689747-97-5) is a chemical compound with molecular formula C16H12F3N5S and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
Also Known As: BAS 06911060, 1-phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine, 1-phenyl-3-(4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl)guanidine, N-Phenyl-N'-(4-thiophen-2-yl-6-trifluoromethyl-pyrimidin-2-yl)-guanidine, N-phenyl-N'-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
| Molecular Formula | C16H12F3N5S |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | 4.2822 |
| Topological Polar Surface Area | 76.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.07654 |
| Heavy Atoms | 25 |
| Complexity | 876.5408 |
Chemical Identifiers
| CAS Number | 689747-97-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N/C(=N/C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3)/N |
Product Overview
1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine (CAS 689747-97-5), with molecular formula C16H12F3N5S and molecular weight 363.08 g/mol. IUPAC: 1-phenyl-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine.
Chemical Property Profile of 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
Property Insights of 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
The XLogP value of 4.2822 indicates that 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine. Following Lipinski's Rule of Five, 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine has 2 hydrogen bond donor(s) and 4 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 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine?
The CAS number of 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine is 689747-97-5.
What is the molecular formula of 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine?
The molecular formula of 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine is C16H12F3N5S.
What is the molecular weight of 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine?
The molecular weight of 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine is 363.08 g/mol.
Where can I buy 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine?
You can request a quote for 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.