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3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one structure
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3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one

TL;DR: 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one (CAS 136860-16-7) is a chemical compound with molecular formula C13H13N5O2 and molecular weight 271.10693 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-amino-6-(dimethylamino)-1-phenylpyrazolo[5,4-d][1,3]oxazin-4-one

Also Known As: 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one, 9F-904, 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4-one, 3-amino-6-(dimethylamino)-1-phenyl-1H,4H-pyrazolo[3,4-d][1,3]oxazin-4-one, 7-amino-3-dimethylamino-9-phenyl-4-oxa-2,8,9-triazabicyclo[4.3.0]nona-2,7,10-trien-5-one

CAS Number
136860-16-7
Molecular Formula
C13H13N5O2
Molecular Weight
271.10693 g/mol
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Technical Specifications

Molecular FormulaC13H13N5O2
Molecular Weight271.10693 g/mol
XLogP1.8
Topological Polar Surface Area (TPSA)85.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass271.10693 Da
Heavy Atoms20
Complexity419.0
SMILESCN(C)C1=NC2=C(C(=NN2C3=CC=CC=C3)N)C(=O)O1
InChIKeyZMTSDAKZZLRRPA-UHFFFAOYSA-N

Chemical Property Profile of 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one

XLogP
1.8
TPSA (Topological Polar Surface Area)
85.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
20
Complexity
419.0
Exact Mass
271.10693
Monoisotopic Mass
271.10693
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 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one. Following Lipinski's Rule of Five, 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one has 1 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 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one?

The CAS number of 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one is 136860-16-7.

What is the molecular formula of 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one?

The molecular formula of 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one is C13H13N5O2.

What is the molecular weight of 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one?

The molecular weight of 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one is 271.10693 g/mol.

Where can I buy 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one?

You can request a quote for 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one?

Yes, CoreyChem provides custom synthesis services for 3-amino-6-(dimethylamino)-1-phenylpyrazolo[3,4-d][1,3]oxazin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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