ChemSpider 2D Image | N-(3-{5-[2-({5-[(Dimethylamino)methyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]imidazo[2,1-b][1,3]thiazol-6-yl}phenyl)-2,6-difluorobenzamide | C32H27F2N7O2S

N-(3-{5-[2-({5-[(Dimethylamino)methyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]imidazo[2,1-b][1,3]thiazol-6-yl}phenyl)-2,6-difluorobenzamide

  • Molecular FormulaC32H27F2N7O2S
  • Average mass611.664 Da
  • Monoisotopic mass611.191528 Da
  • ChemSpider ID24809020

More details:

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

Benzamide, N-[3-[5-[2-[[5-[(dimethylamino)methyl]-2-methoxyphenyl]amino]-4-pyrimidinyl]imidazo[2,1-b]thiazol-6-yl]phenyl]-2,6-difluoro- [ACD/Index Name]
N-(3-{5-[2-({5-[(Dimethylamino)methyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]imidazo[2,1-b][1,3]thiazol-6-yl}phenyl)-2,6-difluorbenzamid [German] [ACD/IUPAC Name]
N-(3-{5-[2-({5-[(Dimethylamino)methyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]imidazo[2,1-b][1,3]thiazol-6-yl}phenyl)-2,6-difluorobenzamide [ACD/IUPAC Name]
N-(3-{5-[2-({5-[(Diméthylamino)méthyl]-2-méthoxyphényl}amino)-4-pyrimidinyl]imidazo[2,1-b][1,3]thiazol-6-yl}phényl)-2,6-difluorobenzamide [French] [ACD/IUPAC Name]
Kinome_736

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: 1.680
Molar Refractivity: 167.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 1.59
ACD/BCF (pH 5.5): 1.93
ACD/KOC (pH 5.5): 8.37
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 56.44
ACD/KOC (pH 7.4): 244.46
Polar Surface Area: 125 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 50.8±7.0 dyne/cm
Molar Volume: 442.1±7.0 cm3

Click to predict properties on the Chemicalize site


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