ChemSpider 2D Image | N-[3-(5-{2-[(4-Morpholin-4-Ylphenyl)amino]pyrimidin-4-Yl}imidazo[2,1-B][1,3]thiazol-6-Yl)phenyl]-2-Phenylacetamide | C33H29N7O2S

N-[3-(5-{2-[(4-Morpholin-4-Ylphenyl)amino]pyrimidin-4-Yl}imidazo[2,1-B][1,3]thiazol-6-Yl)phenyl]-2-Phenylacetamide

  • Molecular FormulaC33H29N7O2S
  • Average mass587.694 Da
  • Monoisotopic mass587.210327 Da
  • ChemSpider ID24667342

More details:






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

Benzeneacetamide, N-[3-[5-[2-[[4-(4-morpholinyl)phenyl]amino]-4-pyrimidinyl]imidazo[2,1-b]thiazol-6-yl]phenyl]- [ACD/Index Name]
N-[3-(5-{2-[(4-Morpholin-4-Ylphenyl)amino]pyrimidin-4-Yl}imidazo[2,1-B][1,3]thiazol-6-Yl)phenyl]-2-Phenylacetamide
N-{3-[5-(2-{[4-(4-Morpholinyl)phenyl]amino}-4-pyrimidinyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-2-phenylacetamid [German] [ACD/IUPAC Name]
N-{3-[5-(2-{[4-(4-Morpholinyl)phenyl]amino}-4-pyrimidinyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-2-phenylacetamide [ACD/IUPAC Name]
N-{3-[5-(2-{[4-(4-Morpholinyl)phényl]amino}-4-pyrimidinyl)imidazo[2,1-b][1,3]thiazol-6-yl]phényl}-2-phénylacétamide [French] [ACD/IUPAC Name]
ITI
Kinome_704

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.729
Molar Refractivity: 170.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.75
ACD/LogD (pH 5.5): 4.66
ACD/BCF (pH 5.5): 1733.56
ACD/KOC (pH 5.5): 6008.24
ACD/LogD (pH 7.4): 4.94
ACD/BCF (pH 7.4): 3310.24
ACD/KOC (pH 7.4): 11472.74
Polar Surface Area: 125 Å2
Polarizability: 67.4±0.5 10-24cm3
Surface Tension: 59.8±7.0 dyne/cm
Molar Volume: 426.6±7.0 cm3

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