ChemSpider 2D Image | 1-(4-{4-[7-Amino-2-(1,2,3-benzothiadiazol-7-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl}-1-piperidinyl)ethanone | C23H21N7O2S

1-(4-{4-[7-Amino-2-(1,2,3-benzothiadiazol-7-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl}-1-piperidinyl)ethanone

  • Molecular FormulaC23H21N7O2S
  • Average mass459.523 Da
  • Monoisotopic mass459.147736 Da
  • ChemSpider ID30823316

More details:

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

1-(4-{4-[7-Amino-2-(1,2,3-benzothiadiazol-7-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl}-1-piperidinyl)ethanon [German] [ACD/IUPAC Name]
1-(4-{4-[7-Amino-2-(1,2,3-benzothiadiazol-7-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl}-1-piperidinyl)ethanone [ACD/IUPAC Name]
1-(4-{4-[7-Amino-2-(1,2,3-benzothiadiazol-7-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl}-1-pipéridinyl)éthanone [French] [ACD/IUPAC Name]
1-(4-{4-[7-Amino-2-(1,2,3-Benzothiadiazol-7-Yl)furo[2,3-C]pyridin-4-Yl]-1h-Pyrazol-1-Yl}piperidin-1-Yl)ethanone
Ethanone, 1-[4-[4-[7-amino-2-(1,2,3-benzothiadiazol-7-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl]-1-piperidinyl]- [ACD/Index Name]
1UL

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

Density: 1.6±0.1 g/cm3
Boiling Point: 759.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.6±3.0 kJ/mol
Flash Point: 412.9±35.7 °C
Index of Refraction: 1.826
Molar Refractivity: 125.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 43.64
ACD/KOC (pH 5.5): 489.85
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 53.46
ACD/KOC (pH 7.4): 600.04
Polar Surface Area: 144 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 72.6±7.0 dyne/cm
Molar Volume: 286.0±7.0 cm3

Click to predict properties on the Chemicalize site


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