4-Chloro-2,5-bis(methylsulfanyl)pyrimidine
TL;DR: 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine (CAS 105856-39-1) is a chemical compound with molecular formula C6H7ClN2S2 and molecular weight 205.97392 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2,5-bis(methylsulfanyl)pyrimidine
Also Known As: 4-chloro-2,5-bis(methylsulfanyl)pyrimidine, Pyrimidine,4-chloro-2,5-bis(methylthio)-
Technical Specifications
| Molecular Formula | C6H7ClN2S2 |
| Molecular Weight | 205.97392 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 76.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.97392 Da |
| Heavy Atoms | 11 |
| Complexity | 125.0 |
| SMILES | CSC1=CN=C(N=C1Cl)SC |
| InChIKey | DYXWWUJFXWSIMY-UHFFFAOYSA-N |
Chemical Property Profile of 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine
Property Insights of 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine. Following Lipinski's Rule of Five, 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine has 0 hydrogen bond donor(s) and 4 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-Chloro-2,5-bis(methylsulfanyl)pyrimidine?
The CAS number of 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine is 105856-39-1.
What is the molecular formula of 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine?
The molecular formula of 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine is C6H7ClN2S2.
What is the molecular weight of 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine?
The molecular weight of 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine is 205.97392 g/mol.
Where can I buy 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine?
You can request a quote for 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine?
Yes, CoreyChem provides custom synthesis services for 4-Chloro-2,5-bis(methylsulfanyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.