ChemSpider 2D Image | 3-Methoxy-4-{3-[4-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]-1H-indazol-6-yl}aniline | C26H27N7O

3-Methoxy-4-{3-[4-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]-1H-indazol-6-yl}aniline

  • Molecular FormulaC26H27N7O
  • Average mass453.539 Da
  • Monoisotopic mass453.227722 Da
  • ChemSpider ID24695526

More details:

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

3-Methoxy-4-{3-[4-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]-1H-indazol-6-yl}anilin [German] [ACD/IUPAC Name]
3-Methoxy-4-{3-[4-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]-1H-indazol-6-yl}aniline [ACD/IUPAC Name]
3-Méthoxy-4-{3-[4-(4-méthyl-1-pipérazinyl)-1H-benzimidazol-2-yl]-1H-indazol-6-yl}aniline [French] [ACD/IUPAC Name]
3-Methoxy-4-{3-[4-(4-Methylpiperazin-1-Yl)-1h-Benzimidazol-2-Yl]-1h-Indazol-6-Yl}aniline
Benzenamine, 3-methoxy-4-[3-[4-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]-1H-indazol-6-yl]- [ACD/Index Name]
EZR
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL471790/
indazole-benzimidazole, 17

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

Density: 1.3±0.1 g/cm3
Boiling Point: 735.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.3±3.0 kJ/mol
Flash Point: 398.5±35.7 °C
Index of Refraction: 1.726
Molar Refractivity: 135.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.88
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 20.26
ACD/KOC (pH 7.4): 233.88
Polar Surface Area: 99 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 68.7±3.0 dyne/cm
Molar Volume: 340.9±3.0 cm3

Click to predict properties on the Chemicalize site


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