ChemSpider 2D Image | N-[4-(Dimethylphosphoryl)phenyl]-9-[(E)-2-(5-methyl-1H-indazol-4-yl)vinyl]-9H-purin-6-amine | C23H22N7OP

N-[4-(Dimethylphosphoryl)phenyl]-9-[(E)-2-(5-methyl-1H-indazol-4-yl)vinyl]-9H-purin-6-amine

  • Molecular FormulaC23H22N7OP
  • Average mass443.441 Da
  • Monoisotopic mass443.162354 Da
  • ChemSpider ID23330439
  • Double-bond stereo - Double-bond stereo


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

926922-39-6 [RN]
N-[4-(DIMETHYLPHOSPHINYL)PHENYL]-9-[(1E)-2-(5-METHYL-1H-INDAZOL-4-YL)ETHENYL]-9H-PURIN-6-AMINE
N-[4-(dimethylphosphoryl)phenyl]-9-[(E)-2-(5-methyl-1H-indazol-4-yl)ethenyl]-9H-purin-6-amine
N-[4-(Dimethylphosphoryl)phenyl]-9-[(E)-2-(5-methyl-1H-indazol-4-yl)vinyl]-9H-purin-6-amin [German] [ACD/IUPAC Name]
N-[4-(Dimethylphosphoryl)phenyl]-9-[(E)-2-(5-methyl-1H-indazol-4-yl)vinyl]-9H-purin-6-amine [ACD/IUPAC Name]
N-[4-(Diméthylphosphoryl)phényl]-9-[(E)-2-(5-méthyl-1H-indazol-4-yl)vinyl]-9H-purin-6-amine [French] [ACD/IUPAC Name]
(E)-dimethyl(4-((9-(2-(5-methyl-1H-indazol-4-yl)vinyl)-9H-purin-6-yl)amino)phenyl)phosphine oxide
9H-Purin-6-amine, N-[4-(dimethylphosphinyl)phenyl]-9-[(1E)-2-(5-methyl-1H-indazol-4-yl)ethenyl]-
9H-purin-6-amine, N-[4-(dimethylphosphinyl)phenyl]-9-[(E)-2-(5-methyl-1H-indazol-4-yl)ethenyl]- [ACD/Index Name]
B90
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 790.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.0±3.0 kJ/mol
Flash Point: 431.8±35.7 °C
Index of Refraction: 1.729
Molar Refractivity: 125.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 188.42
ACD/KOC (pH 5.5): 1479.23
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 188.58
ACD/KOC (pH 7.4): 1480.48
Polar Surface Area: 111 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 60.6±7.0 dyne/cm
Molar Volume: 314.1±7.0 cm3

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