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N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine structure
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N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

TL;DR: N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 120765-47-1) is a chemical compound with molecular formula C11H8ClN5 and molecular weight 245.04683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(4-chlorophenyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine

Also Known As: N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, 5-Ethoxy-2-ethylsulfanyl-1H-benzoimidazole, F2824-0008, (4-Chloro-phenyl)-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)-amine, 1H-Pyrazolo[3,4-d]pyrimidin-4-amine, N-(4-chlorophenyl)-

CAS Number
120765-47-1
Molecular Formula
C11H8ClN5
Molecular Weight
245.04683 g/mol
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Technical Specifications

Molecular FormulaC11H8ClN5
Molecular Weight245.04683 g/mol
XLogP2.7
Topological Polar Surface Area (TPSA)66.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass245.04683 Da
Heavy Atoms17
Complexity256.0
SMILESC1=CC(=CC=C1NC2=NC=NC3=C2C=NN3)Cl
InChIKeyYWMOBFXAHDWFSP-UHFFFAOYSA-N

Chemical Property Profile of N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

XLogP
2.7
TPSA (Topological Polar Surface Area)
66.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
17
Complexity
256.0
Exact Mass
245.04683
Monoisotopic Mass
245.04683
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chlorophenyl)-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-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine. Following Lipinski's Rule of Five, N-(4-chlorophenyl)-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-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?

The CAS number of N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 120765-47-1.

What is the molecular formula of N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?

The molecular formula of N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is C11H8ClN5.

What is the molecular weight of N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?

The molecular weight of N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 245.04683 g/mol.

Where can I buy N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?

You can request a quote for N-(4-chlorophenyl)-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-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine?

Yes, CoreyChem provides custom synthesis services for N-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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