![N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine structure](/static/products/100/100123-81-7.webp)
N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
TL;DR: N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 100123-81-7) is a chemical compound with molecular formula C12H10ClN5 and molecular weight 259.06247 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-chlorophenyl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
Also Known As: N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, pyrazolo[3,4-d]pyrimidine, 4-(4-chlorobenzylamino)-, N-(4-chlorobenzyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine, N-[(4-chlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine, N-[(4-chlorophenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-amine
Technical Specifications
| Molecular Formula | C12H10ClN5 |
| Molecular Weight | 259.06247 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.06247 Da |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
| SMILES | C1=CC(=CC=C1CNC2=NC=NC3=C2C=NN3)Cl |
| InChIKey | HIJAYGQGZJIOQK-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Property Insights of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine. Following Lipinski's Rule of Five, N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The CAS number of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 100123-81-7.
What is the molecular formula of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The molecular formula of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is C12H10ClN5.
What is the molecular weight of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The molecular weight of N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 259.06247 g/mol.
Where can I buy N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
You can request a quote for N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
Yes, CoreyChem provides custom synthesis services for N-(4-chlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.