2,6-Dimethoxy-4-pyrimidinethiol
TL;DR: 2,6-Dimethoxy-4-pyrimidinethiol (CAS 51793-95-4) is a chemical compound with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethoxy-1H-pyrimidine-4-thione
Also Known As: 2,6-dimethoxypyrimidine-4-thiol, 2,4-DIMETHOXY-6-MERCAPTOPYRIMIDINE, 2,6-dimethoxy-1H-pyrimidine-4-thione, 7687AF, 2,6-DIMETHOXY-4-PYRIMIDINETHIOL
| Molecular Formula | C6H8N2O2S |
|---|---|
| Molecular Weight | 172.03 g/mol |
| LogP | 1.15639 |
| Topological Polar Surface Area | 47.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.03065 |
| Heavy Atoms | 11 |
| Complexity | 271.6289 |
Chemical Identifiers
| CAS Number | 51793-95-4 |
|---|---|
| SMILES | COC1=CC(=S)N=C(N1)OC |
Product Overview
2,6-Dimethoxy-4-pyrimidinethiol (CAS 51793-95-4), with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol. IUPAC: 2,6-dimethoxy-1H-pyrimidine-4-thione.
Chemical Property Profile of 2,6-Dimethoxy-4-pyrimidinethiol
Property Insights of 2,6-Dimethoxy-4-pyrimidinethiol
The XLogP value of 1.15639 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethoxy-4-pyrimidinethiol. With a topological polar surface area (TPSA) of 47.14 Ų, 2,6-Dimethoxy-4-pyrimidinethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethoxy-4-pyrimidinethiol has 1 hydrogen bond donor(s) and 4 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-Dimethoxy-4-pyrimidinethiol?
The CAS number of 2,6-Dimethoxy-4-pyrimidinethiol is 51793-95-4.
What is the molecular formula of 2,6-Dimethoxy-4-pyrimidinethiol?
The molecular formula of 2,6-Dimethoxy-4-pyrimidinethiol is C6H8N2O2S.
What is the molecular weight of 2,6-Dimethoxy-4-pyrimidinethiol?
The molecular weight of 2,6-Dimethoxy-4-pyrimidinethiol is 172.03 g/mol.
Where can I buy 2,6-Dimethoxy-4-pyrimidinethiol?
You can request a quote for 2,6-Dimethoxy-4-pyrimidinethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethoxy-4-pyrimidinethiol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethoxy-4-pyrimidinethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.