ChemSpider 2D Image | N-[4-(2-Chloro-5-methyl-4-pyrimidinyl)phenyl]-N-(4-{[(difluoroacetyl)amino]methyl}benzyl)-2,4-dihydroxybenzamide | C28H23ClF2N4O4

N-[4-(2-Chloro-5-methyl-4-pyrimidinyl)phenyl]-N-(4-{[(difluoroacetyl)amino]methyl}benzyl)-2,4-dihydroxybenzamide

  • Molecular FormulaC28H23ClF2N4O4
  • Average mass552.956 Da
  • Monoisotopic mass552.137573 Da
  • ChemSpider ID35034397

More details:






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

Benzamide, N-[4-(2-chloro-5-methyl-4-pyrimidinyl)phenyl]-N-[[4-[[(2,2-difluoroacetyl)amino]methyl]phenyl]methyl]-2,4-dihydroxy- [ACD/Index Name]
N-[4-(2-Chlor-5-methyl-4-pyrimidinyl)phenyl]-N-(4-{[(difluoracetyl)amino]methyl}benzyl)-2,4-dihydroxybenzamid [German] [ACD/IUPAC Name]
N-[4-(2-Chloro-5-méthyl-4-pyrimidinyl)phényl]-N-(4-{[(2,2-difluoroacétyl)amino]méthyl}benzyl)-2,4-dihydroxybenzamide [French] [ACD/IUPAC Name]
N-[4-(2-Chloro-5-methyl-4-pyrimidinyl)phenyl]-N-(4-{[(difluoroacetyl)amino]methyl}benzyl)-2,4-dihydroxybenzamide [ACD/IUPAC Name]
N-[4-(2-Chloro-5-Methylpyrimidin-4-Yl)phenyl]-N-(4-{[(Difluoroacetyl)amino]methyl}benzyl)-2,4-Dihydroxybenzamide
1684386-71-7 [RN]
MFCD28411365
N-(4-(2-Chloro-5-methylpyrimidin-4-yl)phenyl)-N-(4-((2,2-difluoroacetamido)methyl)benzyl)-2,4-dihydroxybenzamide
SZ6
VER-246608

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

Density: 1.4±0.1 g/cm3
Boiling Point: 830.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.8±3.0 kJ/mol
Flash Point: 456.0±34.3 °C
Index of Refraction: 1.649
Molar Refractivity: 142.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 407.84
ACD/KOC (pH 5.5): 2555.61
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 146.70
ACD/KOC (pH 7.4): 919.24
Polar Surface Area: 116 Å2
Polarizability: 56.4±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 390.9±3.0 cm3

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