2(1H)-Pyrimidinethione, 4-phenyl-
TL;DR: 2(1H)-Pyrimidinethione, 4-phenyl- (CAS 1673526-56-1) is a chemical compound with molecular formula C10H8N2S and molecular weight 188.04082 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-phenyl-1H-pyrimidine-2-thione
Also Known As: 4-Phenylpyrimidine-2-thiol, 4-Phenyl-pyrimidine-2-thiol, 2-Mercapto-4-phenylpyrimidine, 6-phenyl-1H-pyrimidine-2-thione, 6-Phenylpyrimidine-2(1H)-thione
Technical Specifications
| Molecular Formula | C10H8N2S |
| Molecular Weight | 188.04082 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 56.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.04082 Da |
| Heavy Atoms | 13 |
| Complexity | 262.0 |
| SMILES | C1=CC=C(C=C1)C2=CC=NC(=S)N2 |
| InChIKey | SXIMWFPBGWZKAV-UHFFFAOYSA-N |
Chemical Property Profile of 2(1H)-Pyrimidinethione, 4-phenyl-
Property Insights of 2(1H)-Pyrimidinethione, 4-phenyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Pyrimidinethione, 4-phenyl-. With a topological polar surface area (TPSA) of 56.5 Ų, 2(1H)-Pyrimidinethione, 4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Pyrimidinethione, 4-phenyl- 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 2(1H)-Pyrimidinethione, 4-phenyl-?
The CAS number of 2(1H)-Pyrimidinethione, 4-phenyl- is 1673526-56-1.
What is the molecular formula of 2(1H)-Pyrimidinethione, 4-phenyl-?
The molecular formula of 2(1H)-Pyrimidinethione, 4-phenyl- is C10H8N2S.
What is the molecular weight of 2(1H)-Pyrimidinethione, 4-phenyl-?
The molecular weight of 2(1H)-Pyrimidinethione, 4-phenyl- is 188.04082 g/mol.
Where can I buy 2(1H)-Pyrimidinethione, 4-phenyl-?
You can request a quote for 2(1H)-Pyrimidinethione, 4-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2(1H)-Pyrimidinethione, 4-phenyl-?
Yes, CoreyChem provides custom synthesis services for 2(1H)-Pyrimidinethione, 4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.