ChemSpider 2D Image | N-(2,6-Difluorobenzyl)-3-[1-(4,5-dimethyl-6-oxo-1,6-dihydro-2-pyrimidinyl)-3,5-dimethyl-1H-pyrazol-4-yl]propanamide | C21H23F2N5O2

N-(2,6-Difluorobenzyl)-3-[1-(4,5-dimethyl-6-oxo-1,6-dihydro-2-pyrimidinyl)-3,5-dimethyl-1H-pyrazol-4-yl]propanamide

  • Molecular FormulaC21H23F2N5O2
  • Average mass415.436 Da
  • Monoisotopic mass415.181976 Da
  • ChemSpider ID22528053

More details:






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

1H-Pyrazole-4-propanamide, N-[(2,6-difluorophenyl)methyl]-1-(1,6-dihydro-4,5-dimethyl-6-oxo-2-pyrimidinyl)-3,5-dimethyl- [ACD/Index Name]
N-(2,6-Difluorbenzyl)-3-[1-(4,5-dimethyl-6-oxo-1,6-dihydro-2-pyrimidinyl)-3,5-dimethyl-1H-pyrazol-4-yl]propanamid [German] [ACD/IUPAC Name]
N-(2,6-Difluorobenzyl)-3-[1-(4,5-dimethyl-6-oxo-1,6-dihydro-2-pyrimidinyl)-3,5-dimethyl-1H-pyrazol-4-yl]propanamide [ACD/IUPAC Name]
N-(2,6-Difluorobenzyl)-3-[1-(4,5-diméthyl-6-oxo-1,6-dihydro-2-pyrimidinyl)-3,5-diméthyl-1H-pyrazol-4-yl]propanamide [French] [ACD/IUPAC Name]
1170460-18-0 [RN]
N-(2,6-difluorobenzyl)-3-(1-(4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl)propanamide
N-[(2,6-difluorophenyl)methyl]-3-[1-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]propanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.614
Molar Refractivity: 108.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.33
ACD/KOC (pH 5.5): 424.76
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 10.55
ACD/KOC (pH 7.4): 134.48
Polar Surface Area: 88 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 42.6±7.0 dyne/cm
Molar Volume: 311.4±7.0 cm3

Click to predict properties on the Chemicalize site






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