4-Amino-1-tert-butyl-3-(2-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine supplier

Name
4-Amino-1-tert-butyl-3-(2-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
EINECS
CAS No. 1027572-46-8
Density 1.347 g/cm³
Solubility
Melting Point
Formula C₁₅H₁₇N₅O
Boiling Point 500.657 °C at 760 mmHg
Molecular Weight 283.33
Flash Point 256.589 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(4-Amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenol;
PSA 89.85000
LogP 3.11730

4-Amino-1-tert-butyl-3-(2-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine Specification

The chemical with CAS registry number of 1027572-46-8 is known as 4-Amino-1-tert-butyl-3-(2-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine. The systematic name is 2-(4-Amino-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-3-yl)phenol. In addition, the formula is C₁₅H₁₇N₅O and the molecular weight is 283.33. This chemical can be used as an inhibitor of enzymes.

Physical properties about 4-Amino-1-tert-butyl-3-(2-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine are: (1)ACD/LogP: 2.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.584; (4)ACD/LogD (pH 7.4): 2.483; (5)ACD/BCF (pH 5.5): 53.356; (6)ACD/BCF (pH 7.4): 42.315; (7)ACD/KOC (pH 5.5): 588.808; (8)ACD/KOC (pH 7.4): 466.958; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.685; (13)Molar Refractivity: 79.889 cm³; (14)Molar Volume: 210.309 cm³; (15)Surface Tension: 53.088 dyne/cm; (16)Density: 1.347 g/cm³; (17)Flash Point: 256.589 °C; (18)Enthalpy of Vaporization: 79.847 kJ/mol; (19)Boiling Point: 500.657 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: CC(C)(C)n1c2c(c(n1)c3ccccc3O)c(ncn2)N
2. InChI: InChI=1/C15H17N5O/c1-15(2,3)20-14-11(13(16)17-8-18-14)12(19-20)9-6-4-5-7-10(9)21/h4-8,21H,1-3H3,(H2,16,17,18)
3. InChIKey: CPZBAYHPGAUAKO-UHFFFAOYAO

Product Name

4-Amino-1-tert-butyl-3-(2-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine

4-Amino-1-tert-butyl-3-(2-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine Specification

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