Metet
TL;DR: Metet (CAS 3736-05-8) is a chemical compound with molecular formula C10H14N4O2S and molecular weight 254.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7-(2-methylsulfanylethyl)purine-2,6-dione
Also Known As: metet, 7-(beta-Methylthioethyl)theophylline, 7 beta-methylthioethyltheophylline, 7-(beta-Metylotioetylo)-teofilina, 7-[2-(Methylthio)ethyl]theophyline
| Molecular Formula | C10H14N4O2S |
|---|---|
| Molecular Weight | 254.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 83.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.08374 |
| Heavy Atoms | 17 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 3736-05-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCSC |
| InChIKey | JRAVCFJEITZUQS-UHFFFAOYSA-N |
Product Overview
Metet (CAS 3736-05-8), with molecular formula C10H14N4O2S and molecular weight 254.08 g/mol. IUPAC: 1,3-dimethyl-7-(2-methylsulfanylethyl)purine-2,6-dione.
Chemical Property Profile of Metet
Property Insights of Metet
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Metet. The TPSA of 83.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Metet. Following Lipinski's Rule of Five, Metet 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
Frequently Asked Questions
What is the CAS number of Metet?
The CAS number of Metet is 3736-05-8.
What is the molecular formula of Metet?
The molecular formula of Metet is C10H14N4O2S.
What is the molecular weight of Metet?
The molecular weight of Metet is 254.08 g/mol.
Where can I buy Metet?
You can request a quote for Metet directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Metet?
Yes, KEHONG BIO provides custom synthesis services for Metet and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.