ChemSpider 2D Image | 4-({[4-(3-Methylbenzoyl)-2-pyridinyl]amino}methyl)benzenecarboximidamide | C21H20N4O

4-({[4-(3-Methylbenzoyl)-2-pyridinyl]amino}methyl)benzenecarboximidamide

  • Molecular FormulaC21H20N4O
  • Average mass344.410 Da
  • Monoisotopic mass344.163696 Da
  • ChemSpider ID22377215

More details:






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

4-({[4-(3-Methylbenzoyl)-2-pyridinyl]amino}methyl)benzenecarboximidamide [ACD/IUPAC Name]
4-({[4-(3-Méthylbenzoyl)-2-pyridinyl]amino}méthyl)benzènecarboximidamide [French] [ACD/IUPAC Name]
4-({[4-(3-Methylbenzoyl)-2-pyridinyl]amino}methyl)benzolcarboximidamid [German] [ACD/IUPAC Name]
4-({[4-(3-METHYLBENZOYL)PYRIDIN-2-YL]AMINO}METHYL)BENZENECARBOXIMIDAMIDE
Benzenecarboximidamide, 4-[[[4-(3-methylbenzoyl)-2-pyridinyl]amino]methyl]- [ACD/Index Name]
4-({[4-(3-methylbenzoyl)pyridin-2-yl]amino}methyl)benzene-1-carboximidamide
4-[({4-[(3-methylphenyl)carbonyl]pyridin-2-yl}amino)methyl]benzene-1-carboximidamide
G44

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 572.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 299.9±32.9 °C
Index of Refraction: 1.639
Molar Refractivity: 102.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 0.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.34
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.07
Polar Surface Area: 92 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 284.4±7.0 cm3

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