ChemSpider 2D Image | 3-(3-Chloro-4-methoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl}-3,4-dihydro-1-phthalazinecarboxamide | C27H25ClN6O4

3-(3-Chloro-4-methoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl}-3,4-dihydro-1-phthalazinecarboxamide

  • Molecular FormulaC27H25ClN6O4
  • Average mass532.978 Da
  • Monoisotopic mass532.162598 Da
  • ChemSpider ID17321845

More details:

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

1-Phthalazinecarboxamide, 3-(3-chloro-4-methoxyphenyl)-3,4-dihydro-4-oxo-N-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]- [ACD/Index Name]
3-(3-Chlor-4-methoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl}-3,4-dihydro-1-phthalazincarboxamid [German] [ACD/IUPAC Name]
3-(3-Chloro-4-méthoxyphényl)-4-oxo-N-{2-oxo-2-[4-(2-pyridinyl)-1-pipérazinyl]éthyl}-3,4-dihydro-1-phtalazinecarboxamide [French] [ACD/IUPAC Name]
3-(3-Chloro-4-methoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl}-3,4-dihydro-1-phthalazinecarboxamide [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: 1.686
Molar Refractivity: 143.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.00
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 5.15
ACD/KOC (pH 7.4): 54.09
Polar Surface Area: 107 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 58.2±7.0 dyne/cm
Molar Volume: 377.3±7.0 cm3

Click to predict properties on the Chemicalize site


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