ChemSpider 2D Image | N-(3-{4-[(2-Benzyl-5-methoxy-1-methyl-6-oxo-1,6-dihydro-4-pyrimidinyl)carbonyl]-1-piperazinyl}propyl)-3,4,5-trihydroxybenzamide | C28H33N5O7

N-(3-{4-[(2-Benzyl-5-methoxy-1-methyl-6-oxo-1,6-dihydro-4-pyrimidinyl)carbonyl]-1-piperazinyl}propyl)-3,4,5-trihydroxybenzamide

  • Molecular FormulaC28H33N5O7
  • Average mass551.591 Da
  • Monoisotopic mass551.237976 Da
  • ChemSpider ID58962106

More details:

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

Benzamide, N-[3-[4-[[1,6-dihydro-5-methoxy-1-methyl-6-oxo-2-(phenylmethyl)-4-pyrimidinyl]carbonyl]-1-piperazinyl]propyl]-3,4,5-trihydroxy- [ACD/Index Name]
N-(3-{4-[(2-Benzyl-5-methoxy-1-methyl-6-oxo-1,6-dihydro-4-pyrimidinyl)carbonyl]-1-piperazinyl}propyl)-3,4,5-trihydroxybenzamid [German] [ACD/IUPAC Name]
N-(3-{4-[(2-Benzyl-5-methoxy-1-methyl-6-oxo-1,6-dihydro-4-pyrimidinyl)carbonyl]-1-piperazinyl}propyl)-3,4,5-trihydroxybenzamide [ACD/IUPAC Name]
N-(3-{4-[(2-Benzyl-5-méthoxy-1-méthyl-6-oxo-1,6-dihydro-4-pyrimidinyl)carbonyl]-1-pipérazinyl}propyl)-3,4,5-trihydroxybenzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.650
Molar Refractivity: 145.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -0.04
ACD/LogD (pH 5.5): -1.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.19
Polar Surface Area: 155 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 57.1±7.0 dyne/cm
Molar Volume: 398.7±7.0 cm3

Click to predict properties on the Chemicalize site


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