ChemSpider 2D Image | N-(3-Fluoro-4-{[2-({3-[(methylsulfonyl)methyl]phenyl}amino)-4-pyrimidinyl]oxy}phenyl)-N'-(4-fluorophenyl)-1,1-cyclopropanedicarboxamide | C29H25F2N5O5S

N-(3-Fluoro-4-{[2-({3-[(methylsulfonyl)methyl]phenyl}amino)-4-pyrimidinyl]oxy}phenyl)-N'-(4-fluorophenyl)-1,1-cyclopropanedicarboxamide

  • Molecular FormulaC29H25F2N5O5S
  • Average mass593.601 Da
  • Monoisotopic mass593.154419 Da
  • ChemSpider ID34217299

More details:






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

1,1-Cyclopropanedicarboxamide, N-[3-fluoro-4-[[2-[[3-[(methylsulfonyl)methyl]phenyl]amino]-4-pyrimidinyl]oxy]phenyl]-N'-(4-fluorophenyl)- [ACD/Index Name]
N-(3-Fluor-4-{[2-({3-[(methylsulfonyl)methyl]phenyl}amino)-4-pyrimidinyl]oxy}phenyl)-N'-(4-fluorphenyl)-1,1-cyclopropandicarboxamid [German] [ACD/IUPAC Name]
N-(3-Fluoro-4-{[2-({3-[(methylsulfonyl)methyl]phenyl}amino)-4-pyrimidinyl]oxy}phenyl)-N'-(4-fluorophenyl)-1,1-cyclopropanedicarboxamide [ACD/IUPAC Name]
N-(3-Fluoro-4-{[2-({3-[(méthylsulfonyl)méthyl]phényl}amino)-4-pyrimidinyl]oxy}phényl)-N'-(4-fluorophényl)-1,1-cyclopropanedicarboxamide [French] [ACD/IUPAC Name]
N-(3-Fluoro-4-{[2-({3-[(Methylsulfonyl)methyl]phenyl}amino)pyrimidin-4-Yl]oxy}phenyl)-N'-(4-Fluorophenyl)cyclopropane-1,1-Dicarboxamide
DWF

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.679
Molar Refractivity: 148.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.04
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 151.43
ACD/KOC (pH 5.5): 1261.01
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 153.23
ACD/KOC (pH 7.4): 1276.01
Polar Surface Area: 148 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 77.1±3.0 dyne/cm
Molar Volume: 394.2±3.0 cm3

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