4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine
TL;DR: 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine (CAS 69259-10-5) is a chemical compound with molecular formula C11H14N4O4S and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-5-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-2-yl)oxolane-3,4-diol
Also Known As: 2H-Pyrazolo[3, 4-(methylthio)-2-.beta.-D-ribofuranosyl-, 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine, 2H-Pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-2-.beta.-D-ribofuranosyl-, 2H-Pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-2-beta-D-ribofuranosyl-, 2-(hydroxymethyl)-5-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-2-yl)oxolane-3,4-diol
| Molecular Formula | C11H14N4O4S |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.07358 |
| Heavy Atoms | 20 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 69259-10-5 |
|---|---|
| SMILES | CSC1=NC=NC2=NN(C=C21)C3C(C(C(O3)CO)O)O |
| InChIKey | RILARCZNYHFELC-UHFFFAOYSA-N |
Product Overview
4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine (CAS 69259-10-5), with molecular formula C11H14N4O4S and molecular weight 298.07 g/mol. IUPAC: 2-(hydroxymethyl)-5-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-2-yl)oxolane-3,4-diol.
Chemical Property Profile of 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine
Property Insights of 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine
The XLogP value of -0.6 indicates that 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine. Following Lipinski's Rule of Five, 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine has 3 hydrogen bond donor(s) and 8 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-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine is 69259-10-5.
What is the molecular formula of 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine is C11H14N4O4S.
What is the molecular weight of 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine is 298.07 g/mol.
Where can I buy 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 4-(Methylsulfanyl)-2-pentofuranosyl-2H-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-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methylsulfanyl)-2-pentofuranosyl-2H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.