ChemSpider 2D Image | N-(3-{[(5-Chloro-2-{[3,5-dichloro-4-(4-methyl-1-piperazinyl)phenyl]amino}-4-pyrimidinyl)amino]methyl}phenyl)acrylamide | C25H26Cl3N7O

N-(3-{[(5-Chloro-2-{[3,5-dichloro-4-(4-methyl-1-piperazinyl)phenyl]amino}-4-pyrimidinyl)amino]methyl}phenyl)acrylamide

  • Molecular FormulaC25H26Cl3N7O
  • Average mass546.879 Da
  • Monoisotopic mass545.126465 Da
  • ChemSpider ID58978503

More details:

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

2-Propenamide, N-[3-[[[5-chloro-2-[[3,5-dichloro-4-(4-methyl-1-piperazinyl)phenyl]amino]-4-pyrimidinyl]amino]methyl]phenyl]- [ACD/Index Name]
N-(3-{[(5-Chlor-2-{[3,5-dichlor-4-(4-methyl-1-piperazinyl)phenyl]amino}-4-pyrimidinyl)amino]methyl}phenyl)acrylamid [German] [ACD/IUPAC Name]
N-(3-{[(5-Chloro-2-{[3,5-dichloro-4-(4-methyl-1-piperazinyl)phenyl]amino}-4-pyrimidinyl)amino]methyl}phenyl)acrylamide [ACD/IUPAC Name]
N-(3-{[(5-Chloro-2-{[3,5-dichloro-4-(4-méthyl-1-pipérazinyl)phényl]amino}-4-pyrimidinyl)amino]méthyl}phényl)acrylamide [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: 1.691
Molar Refractivity: 147.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.09
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 82.81
ACD/KOC (pH 5.5): 280.52
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2384.23
ACD/KOC (pH 7.4): 8076.54
Polar Surface Area: 85 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 68.8±3.0 dyne/cm
Molar Volume: 385.9±3.0 cm3

Click to predict properties on the Chemicalize site


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