![4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine structure](/static/products/573/573950-05-7.png)
4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine
TL;DR: 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 573950-05-7) is a chemical compound with molecular formula C20H16N6S and molecular weight 372.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-methylphenyl)pyrazolo[5,4-d]pyrimidine
Also Known As: 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine, 4-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidine, 4-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
| Molecular Formula | C20H16N6S |
|---|---|
| Molecular Weight | 372.12 g/mol |
| LogP | 4.29252 |
| Topological Polar Surface Area | 72.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.11572 |
| Heavy Atoms | 27 |
| Complexity | 1205.5487 |
Chemical Identifiers
| CAS Number | 573950-05-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=NC5=CC=CC=C5N4 |
Product Overview
4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine (CAS 573950-05-7), with molecular formula C20H16N6S and molecular weight 372.12 g/mol. IUPAC: 4-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-methylphenyl)pyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine
Property Insights of 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine
The XLogP value of 4.29252 indicates that 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine. Following Lipinski's Rule of Five, 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-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-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
The CAS number of 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine is 573950-05-7.
What is the molecular formula of 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular formula of 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine is C20H16N6S.
What is the molecular weight of 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
The molecular weight of 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine is 372.12 g/mol.
Where can I buy 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
You can request a quote for 4-(((1H-benzo[d]imidazol-2-yl)methyl)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-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.