![4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine structure](/static/products/667/667883-69-4.png)
4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
TL;DR: 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine (CAS 667883-69-4) is a chemical compound with molecular formula C17H16N4S2 and molecular weight 340.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-4,6-bis(prop-2-enylsulfanyl)pyrazolo[5,4-d]pyrimidine
Also Known As: 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine, AO-476/42008089, 1-phenyl-4,6-bis(prop-2-enylsulfanyl)pyrazolo[3,4-d]pyrimidine
| Molecular Formula | C17H16N4S2 |
|---|---|
| Molecular Weight | 340.08 g/mol |
| LogP | 4.3717 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 340.08163 |
| Heavy Atoms | 23 |
| Complexity | 827.2306 |
Chemical Identifiers
| CAS Number | 667883-69-4 |
|---|---|
| SMILES | C=CCSC1=NC(=NC2=C1C=NN2C3=CC=CC=C3)SCC=C |
Product Overview
4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine (CAS 667883-69-4), with molecular formula C17H16N4S2 and molecular weight 340.08 g/mol. IUPAC: 1-phenyl-4,6-bis(prop-2-enylsulfanyl)pyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Property Insights of 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
The XLogP value of 4.3717 indicates that 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine has 0 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(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is 667883-69-4.
What is the molecular formula of 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is C17H16N4S2.
What is the molecular weight of 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine is 340.08 g/mol.
Where can I buy 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 4,6-bis(allylsulfanyl)-1-phenyl-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(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-bis(allylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.