Styrylpyrimidinethione
TL;DR: Styrylpyrimidinethione (CAS 1243314-15-9) is a chemical compound with molecular formula C12H10N2S and molecular weight 214.05647 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(2-phenylethenyl)-1H-pyrimidine-2-thione
Also Known As: styrylpyrimidinethione, 4-styryl-2-pyrimidinethiol, 6-(2-phenylethenyl)-1H-pyrimidine-2-thione
Technical Specifications
| Molecular Formula | C12H10N2S |
| Molecular Weight | 214.05647 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 56.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.05647 Da |
| Heavy Atoms | 15 |
| Complexity | 323.0 |
| SMILES | C1=CC=C(C=C1)C=CC2=CC=NC(=S)N2 |
| InChIKey | HAKWVAGTNKSIMK-UHFFFAOYSA-N |
Chemical Property Profile of Styrylpyrimidinethione
Property Insights of Styrylpyrimidinethione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Styrylpyrimidinethione. With a topological polar surface area (TPSA) of 56.5 Ų, Styrylpyrimidinethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Styrylpyrimidinethione has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Styrylpyrimidinethione?
The CAS number of Styrylpyrimidinethione is 1243314-15-9.
What is the molecular formula of Styrylpyrimidinethione?
The molecular formula of Styrylpyrimidinethione is C12H10N2S.
What is the molecular weight of Styrylpyrimidinethione?
The molecular weight of Styrylpyrimidinethione is 214.05647 g/mol.
Where can I buy Styrylpyrimidinethione?
You can request a quote for Styrylpyrimidinethione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Styrylpyrimidinethione?
Yes, CoreyChem provides custom synthesis services for Styrylpyrimidinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.