N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
TL;DR: N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 100124-91-2) is a chemical compound with molecular formula C12H9Cl2N5 and molecular weight 293.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
Also Known As: N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine, 1H-Pyrazolo[3,4-d]pyrimidin-4-amine, N-[(2,4-dichlorophenyl)methyl]-, 4-[2,4-Dichlorobenzylamino]pyrazolo[3,4-d]pyrimidine, N-(2,4-Dichlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, N-(2,4-Dichlorobenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine #
| Molecular Formula | C12H9Cl2N5 |
|---|---|
| Molecular Weight | 293.02 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.0235 |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 100124-91-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)CNC2=NC=NC3=C2C=NN3 |
| InChIKey | WTSHYTYECVWTTA-UHFFFAOYSA-N |
Product Overview
N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 100124-91-2), with molecular formula C12H9Cl2N5 and molecular weight 293.02 g/mol. IUPAC: N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
Chemical Property Profile of N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Property Insights of N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
The XLogP value of 3.2 indicates that N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine. Following Lipinski's Rule of Five, N-[(2,4-dichlorophenyl)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-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The CAS number of N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 100124-91-2.
What is the molecular formula of N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The molecular formula of N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine is C12H9Cl2N5.
What is the molecular weight of N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
The molecular weight of N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 293.02 g/mol.
Where can I buy N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
You can request a quote for N-[(2,4-dichlorophenyl)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-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(2,4-dichlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.