4,6-Dimethyl-2-mercaptopyrimidine
TL;DR: 4,6-Dimethyl-2-mercaptopyrimidine (CAS 6622-92-0) is a chemical compound with molecular formula C6H8N2S and molecular weight 140.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-1H-pyrimidine-2-thione
Also Known As: 4,6-Dimethyl-2-mercaptopyrimidine, 2-Mercapto-4,6-dimethylpyrimidine, 4,6-Dimethyl-2(1H)-pyrimidinethione, 4,6-Dimethyl-2-pyrimidinethiol, 4,6-Dimethylpyrimidine-2-thiol
| Molecular Formula | C6H8N2S |
|---|---|
| Molecular Weight | 140.04 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.04082 |
| Heavy Atoms | 9 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 6622-92-0 |
|---|---|
| SMILES | CC1=CC(=NC(=S)N1)C |
| InChIKey | RAFAYWADRVMWFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-Dimethyl-2-mercaptopyrimidine (CAS 6622-92-0), with molecular formula C6H8N2S and molecular weight 140.04 g/mol. IUPAC: 4,6-dimethyl-1H-pyrimidine-2-thione.
Chemical Property Profile of 4,6-Dimethyl-2-mercaptopyrimidine
Property Insights of 4,6-Dimethyl-2-mercaptopyrimidine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dimethyl-2-mercaptopyrimidine. With a topological polar surface area (TPSA) of 56.5 Ų, 4,6-Dimethyl-2-mercaptopyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dimethyl-2-mercaptopyrimidine 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
Frequently Asked Questions
What is the CAS number of 4,6-Dimethyl-2-mercaptopyrimidine?
The CAS number of 4,6-Dimethyl-2-mercaptopyrimidine is 6622-92-0.
What is the molecular formula of 4,6-Dimethyl-2-mercaptopyrimidine?
The molecular formula of 4,6-Dimethyl-2-mercaptopyrimidine is C6H8N2S.
What is the molecular weight of 4,6-Dimethyl-2-mercaptopyrimidine?
The molecular weight of 4,6-Dimethyl-2-mercaptopyrimidine is 140.04 g/mol.
Where can I buy 4,6-Dimethyl-2-mercaptopyrimidine?
You can request a quote for 4,6-Dimethyl-2-mercaptopyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dimethyl-2-mercaptopyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dimethyl-2-mercaptopyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.