ChemSpider 2D Image | 4-Methyl-N-[4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-1-naphthyl]-1H-benzimidazol-2-amine | C28H23N7O

4-Methyl-N-[4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-1-naphthyl]-1H-benzimidazol-2-amine

  • Molecular FormulaC28H23N7O
  • Average mass473.529 Da
  • Monoisotopic mass473.196411 Da
  • ChemSpider ID24690308

More details:

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

1H-Benzimidazol-2-amine, 7-methyl-N-[4-[[3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl]oxy]-1-naphthalenyl]- [ACD/Index Name]
4-Methyl-N-[4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-1-naphthyl]-1H-benzimidazol-2-amin [German] [ACD/IUPAC Name]
4-Methyl-N-[4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-1-naphthyl]-1H-benzimidazol-2-amine [ACD/IUPAC Name]
4-Méthyl-N-[4-({3-[2-(méthylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-1-naphtyl]-1H-benzimidazol-2-amine [French] [ACD/IUPAC Name]
7-methyl-N-(4-(3-(2-(methylamino)pyrimidin-4-yl)pyridin-2-yloxy)naphthalen-1-yl)-1H-benzo[d]imidazol-2-amine
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL457100/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 751.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.5±3.0 kJ/mol
Flash Point: 408.2±35.7 °C
Index of Refraction: 1.767
Molar Refractivity: 143.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 321.37
ACD/KOC (pH 5.5): 1128.17
ACD/LogD (pH 7.4): 4.87
ACD/BCF (pH 7.4): 2868.51
ACD/KOC (pH 7.4): 10070.02
Polar Surface Area: 101 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 346.5±3.0 cm3

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