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Search term: AJRDTQMINSKQOE-ZDUSSCGKSA-N (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-Amino-5-{1-[(1-methyl-3-piperidinyl)methyl]-1H-indol-6-yl}-1H-pyrazole-4-carbonitrile | C19H22N6

3-Amino-5-{1-[(1-methyl-3-piperidinyl)methyl]-1H-indol-6-yl}-1H-pyrazole-4-carbonitrile

  • Molecular FormulaC19H22N6
  • Average mass334.418 Da
  • Monoisotopic mass334.190582 Da
  • ChemSpider ID128730964

More details:

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

1H-Pyrazole-4-carbonitrile, 3-amino-5-[1-[(1-methyl-3-piperidinyl)methyl]-1H-indol-6-yl]- [ACD/Index Name]
3-Amino-5-{1-[(1-methyl-3-piperidinyl)methyl]-1H-indol-6-yl}-1H-pyrazol-4-carbonitril [German] [ACD/IUPAC Name]
3-Amino-5-{1-[(1-methyl-3-piperidinyl)methyl]-1H-indol-6-yl}-1H-pyrazole-4-carbonitrile [ACD/IUPAC Name]
3-Amino-5-{1-[(1-méthyl-3-pipéridinyl)méthyl]-1H-indol-6-yl}-1H-pyrazole-4-carbonitrile [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 659.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 352.7±31.5 °C
Index of Refraction: 1.716
Molar Refractivity: 97.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.20
ACD/LogD (pH 5.5): -0.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.64
Polar Surface Area: 87 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 57.6±7.0 dyne/cm
Molar Volume: 248.0±7.0 cm3

Click to predict properties on the Chemicalize site


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