ChemSpider 2D Image | N-{1-[(1S)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide | C24H32N6O

N-{1-[(1S)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

  • Molecular FormulaC24H32N6O
  • Average mass420.551 Da
  • Monoisotopic mass420.263763 Da
  • ChemSpider ID34247862

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Indazole-3-carboxamide, N-[1-[(1S)-3-(dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl]-4,5,6,7-tetrahydro-6,6-dimethyl- [ACD/Index Name]
N-{1-[(1S)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazol-3-carboxamid [German] [ACD/IUPAC Name]
N-{1-[(1S)-3-(Dimethylamino)-1-phenylpropyl]-1H-pyrazol-4-yl}-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide [ACD/IUPAC Name]
N-{1-[(1S)-3-(Diméthylamino)-1-phénylpropyl]-1H-pyrazol-4-yl}-6,6-diméthyl-4,5,6,7-tétrahydro-1H-indazole-3-carboxamide [French] [ACD/IUPAC Name]
1557232-32-2 [RN]
2W6
GNE-9822
ITK
N-[1-[(1S)-3-(dimethylamino)-1-phenylpropyl]pyrazol-4-yl]-6,6-dimethyl-1,4,5,7-tetrahydroindazole-3-carboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 579.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 304.2±30.1 °C
Index of Refraction: 1.638
Molar Refractivity: 123.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.68
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 5.50
ACD/KOC (pH 7.4): 33.17
Polar Surface Area: 79 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 46.7±7.0 dyne/cm
Molar Volume: 344.2±7.0 cm3

Click to predict properties on the Chemicalize site


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