4-(4-Fluorophenyl)-2-pyrimidinethiol
TL;DR: 4-(4-Fluorophenyl)-2-pyrimidinethiol (CAS 155957-43-0) is a chemical compound with molecular formula C10H7FN2S and molecular weight 206.0314 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(4-fluorophenyl)-1H-pyrimidine-2-thione
Also Known As: 4-(4-fluorophenyl)-2-pyrimidinethiol, 4-(4-fluorophenyl)pyrimidine-2-thiol, fluorophenylpyrimidinethiol, 4-(4-Fluoro-phenyl)-pyrimidine-2-thiol, 6-(4-fluorophenyl)-1H-pyrimidine-2-thione
Technical Specifications
| Molecular Formula | C10H7FN2S |
| Molecular Weight | 206.0314 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 56.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.0314 Da |
| Heavy Atoms | 14 |
| Complexity | 290.0 |
| SMILES | C1=CC(=CC=C1C2=CC=NC(=S)N2)F |
| InChIKey | IKNROSDVLWITKJ-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-Fluorophenyl)-2-pyrimidinethiol
Property Insights of 4-(4-Fluorophenyl)-2-pyrimidinethiol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Fluorophenyl)-2-pyrimidinethiol. With a topological polar surface area (TPSA) of 56.5 Ų, 4-(4-Fluorophenyl)-2-pyrimidinethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Fluorophenyl)-2-pyrimidinethiol 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
What is the CAS number of 4-(4-Fluorophenyl)-2-pyrimidinethiol?
The CAS number of 4-(4-Fluorophenyl)-2-pyrimidinethiol is 155957-43-0.
What is the molecular formula of 4-(4-Fluorophenyl)-2-pyrimidinethiol?
The molecular formula of 4-(4-Fluorophenyl)-2-pyrimidinethiol is C10H7FN2S.
What is the molecular weight of 4-(4-Fluorophenyl)-2-pyrimidinethiol?
The molecular weight of 4-(4-Fluorophenyl)-2-pyrimidinethiol is 206.0314 g/mol.
Where can I buy 4-(4-Fluorophenyl)-2-pyrimidinethiol?
You can request a quote for 4-(4-Fluorophenyl)-2-pyrimidinethiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-Fluorophenyl)-2-pyrimidinethiol?
Yes, CoreyChem provides custom synthesis services for 4-(4-Fluorophenyl)-2-pyrimidinethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.