![4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine structure](/static/products/6950/6950-18-1.webp)
4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine
TL;DR: 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine (CAS 6950-18-1) is a chemical compound with molecular formula C7H8N4S2 and molecular weight 212.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-bis(methylsulfanyl)-1H-pyrazolo[5,4-d]pyrimidine
Also Known As: 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine, 4,6-bis(methylsulfanyl)-1h-pyrazolo[3,4-d]pyrimidine, 1H-Pyrazolo[3,4-d]pyrimidine,4,6-bis(methylthio)-, 4,6-dimethylmercaptopyrazolo[3,4-d]pyrimidine, 4,6-bismethylmercapto-pyrazolo[3,4-d]pyrimidine
| Molecular Formula | C7H8N4S2 |
|---|---|
| Molecular Weight | 212.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.01904 |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 6950-18-1 |
|---|---|
| SMILES | CSC1=NC(=NC2=C1C=NN2)SC |
| InChIKey | PSGYPWNZPPVWPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine (CAS 6950-18-1), with molecular formula C7H8N4S2 and molecular weight 212.02 g/mol. IUPAC: 4,6-bis(methylsulfanyl)-1H-pyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine
Property Insights of 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine. Following Lipinski's Rule of Five, 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine has 1 hydrogen bond donor(s) and 5 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-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine is 6950-18-1.
What is the molecular formula of 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine is C7H8N4S2.
What is the molecular weight of 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine is 212.02 g/mol.
Where can I buy 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Bis(methylthio)-1H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.