2,6-Dimethylpyrimidine-4-thiol
TL;DR: 2,6-Dimethylpyrimidine-4-thiol (CAS 57235-36-6) 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.
2,6-dimethyl-1H-pyrimidine-4-thione
Also Known As: 2,6-dimethylpyrimidine-4-thiol, 2,6-dimethyl-1H-pyrimidine-4-thione, 4(1H)-Pyrimidinethione, 2,6-dimethyl- (9CI), 4 -Pyrimidinethione,2,6-dimethyl-, 2,6-dimethylpyrimidine-4(3H)-thione
| Molecular Formula | C6H8N2S |
|---|---|
| Molecular Weight | 140.04 g/mol |
| LogP | 1.75603 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.04082 |
| Heavy Atoms | 9 |
| Complexity | 240.75552 |
Chemical Identifiers
| CAS Number | 57235-36-6 |
|---|---|
| SMILES | CC1=CC(=S)N=C(N1)C |
Product Overview
2,6-Dimethylpyrimidine-4-thiol (CAS 57235-36-6), with molecular formula C6H8N2S and molecular weight 140.04 g/mol. IUPAC: 2,6-dimethyl-1H-pyrimidine-4-thione.
Chemical Property Profile of 2,6-Dimethylpyrimidine-4-thiol
Property Insights of 2,6-Dimethylpyrimidine-4-thiol
The XLogP value of 1.75603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethylpyrimidine-4-thiol. With a topological polar surface area (TPSA) of 28.68 Ų, 2,6-Dimethylpyrimidine-4-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethylpyrimidine-4-thiol 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
Frequently Asked Questions
What is the CAS number of 2,6-Dimethylpyrimidine-4-thiol?
The CAS number of 2,6-Dimethylpyrimidine-4-thiol is 57235-36-6.
What is the molecular formula of 2,6-Dimethylpyrimidine-4-thiol?
The molecular formula of 2,6-Dimethylpyrimidine-4-thiol is C6H8N2S.
What is the molecular weight of 2,6-Dimethylpyrimidine-4-thiol?
The molecular weight of 2,6-Dimethylpyrimidine-4-thiol is 140.04 g/mol.
Where can I buy 2,6-Dimethylpyrimidine-4-thiol?
You can request a quote for 2,6-Dimethylpyrimidine-4-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethylpyrimidine-4-thiol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethylpyrimidine-4-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.