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4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine structure
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4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine

TL;DR: 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine (CAS 58791-67-6) is a chemical compound with molecular formula C12H12N6 and molecular weight 240.11235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-methyl-3-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine

Also Known As: 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine, 1-methyl-3-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine, 1-Methyl-3-phenyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine, 1-Methyl-3-phenyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine #

CAS Number
58791-67-6
Molecular Formula
C12H12N6
Molecular Weight
240.11235 g/mol
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Technical Specifications

Molecular FormulaC12H12N6
Molecular Weight240.11235 g/mol
XLogP1.2
Topological Polar Surface Area (TPSA)95.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass240.11235 Da
Heavy Atoms18
Complexity292.0
SMILESCN1C2=NC(=NC(=C2C(=N1)C3=CC=CC=C3)N)N
InChIKeyWTIZUBKJGAHNCS-UHFFFAOYSA-N

Chemical Property Profile of 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine

XLogP
1.2
TPSA (Topological Polar Surface Area)
95.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
18
Complexity
292.0
Exact Mass
240.11235
Monoisotopic Mass
240.11235
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 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine

The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine. Following Lipinski's Rule of Five, 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine?

The CAS number of 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine is 58791-67-6.

What is the molecular formula of 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine?

The molecular formula of 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine is C12H12N6.

What is the molecular weight of 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine?

The molecular weight of 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine is 240.11235 g/mol.

Where can I buy 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine?

You can request a quote for 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine?

Yes, CoreyChem provides custom synthesis services for 4,6-Diamino-1-methyl-3-phenyl pyrazolo[3,4-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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