![4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine structure](/static/products/579/579441-41-1.png)
4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine
TL;DR: 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 579441-41-1) is a chemical compound with molecular formula C23H18N4S and molecular weight 382.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-4-(naphthalen-1-ylmethylsulfanyl)pyrazolo[5,4-d]pyrimidine
Also Known As: 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine, 1-(4-methylphenyl)-4-(naphthalen-1-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine, 1-(4-methylphenyl)-4-[(naphthalen-1-ylmethyl)sulfanyl]-1H-pyrazolo[3,4-d]pyrimidine
| Molecular Formula | C23H18N4S |
|---|---|
| Molecular Weight | 382.13 g/mol |
| LogP | 5.56942 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.1252 |
| Heavy Atoms | 28 |
| Complexity | 1269.7863 |
Chemical Identifiers
| CAS Number | 579441-41-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC5=CC=CC=C54 |
Product Overview
4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 579441-41-1), with molecular formula C23H18N4S and molecular weight 382.13 g/mol. IUPAC: 1-(4-methylphenyl)-4-(naphthalen-1-ylmethylsulfanyl)pyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine
Property Insights of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine
The XLogP value of 5.56942 indicates that 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-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-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine is 579441-41-1.
What is the molecular formula of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine is C23H18N4S.
What is the molecular weight of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine is 382.13 g/mol.
Where can I buy 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-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-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-((naphthalen-1-ylmethyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.