![N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine structure](/static/products/1065/106598-06-5.webp)
N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
TL;DR: N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 106598-06-5) is a chemical compound with molecular formula C13H13N5 and molecular weight 239.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-methylphenyl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
Also Known As: NCIStruc1_000355, NCIStruc2_000421, NCI60_004098, 4-<3-Methyl-benzylamino>-pyrazolo<3,4-d>pyrimidin, N-(3-methylbenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
| Molecular Formula | C13H13N5 |
|---|---|
| Molecular Weight | 239.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.1171 |
| Heavy Atoms | 18 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 106598-06-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CNC2=NC=NC3=C2C=NN3 |
| InChIKey | UTHHQUPEUGZVEP-UHFFFAOYSA-N |
Product Overview
N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 106598-06-5), with molecular formula C13H13N5 and molecular weight 239.12 g/mol. IUPAC: N-[(3-methylphenyl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
Chemical Property Profile of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Property Insights of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-methylphenyl)methyl]-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-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine. Following Lipinski's Rule of Five, N-[(3-methylphenyl)methyl]-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
Frequently Asked Questions
What is the CAS number of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The CAS number of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 106598-06-5.
What is the molecular formula of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The molecular formula of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine is C13H13N5.
What is the molecular weight of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The molecular weight of N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 239.12 g/mol.
Where can I buy N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
You can request a quote for N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.