ChemSpider 2D Image | 4-(2-Amino-5-{4-[(dimethylamino)methyl]-2-thienyl}-3-pyridinyl)-2-{[(2R,3Z)-5,5,5-trifluoro-3-penten-2-yl]oxy}benzamide | C24H25F3N4O2S

4-(2-Amino-5-{4-[(dimethylamino)methyl]-2-thienyl}-3-pyridinyl)-2-{[(2R,3Z)-5,5,5-trifluoro-3-penten-2-yl]oxy}benzamide

  • Molecular FormulaC24H25F3N4O2S
  • Average mass490.541 Da
  • Monoisotopic mass490.165039 Da
  • ChemSpider ID28507827

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1364269-10-2 [RN]
4-(2-Amino-5-{4-[(dimethylamino)methyl]-2-thienyl}-3-pyridinyl)-2-{[(2R,3Z)-5,5,5-trifluor-3-penten-2-yl]oxy}benzamid [German] [ACD/IUPAC Name]
4-(2-Amino-5-{4-[(dimethylamino)methyl]-2-thienyl}-3-pyridinyl)-2-{[(2R,3Z)-5,5,5-trifluoro-3-penten-2-yl]oxy}benzamide [ACD/IUPAC Name]
4-(2-Amino-5-{4-[(diméthylamino)méthyl]-2-thiényl}-3-pyridinyl)-2-{[(2R,3Z)-5,5,5-trifluoro-3-pentén-2-yl]oxy}benzamide [French] [ACD/IUPAC Name]
4-(2-amino-5-{4-[(dimethylamino)methyl]thiophen-2-yl}pyridin-3-yl)-2-{[(1R,2Z)-4,4,4-trifluoro-1-methylbut-2-en-1-yl]oxy}benzamide
Benzamide, 4-[2-amino-5-[4-[(dimethylamino)methyl]-2-thienyl]-3-pyridinyl]-2-[[(1R,2Z)-4,4,4-trifluoro-1-methyl-2-buten-1-yl]oxy]- [ACD/Index Name]
4-(2-Amino-5-{4-[(Dimethylamino)methyl]thiophen-2-Yl}pyridin-3-Yl)-2-{[(1r,2z)-4,4,4-Trifluoro-1-Methylbut-2-En-1-Yl]oxy} Benzamide
GGY

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 582.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.3±30.1 °C
Index of Refraction: 1.591
Molar Refractivity: 128.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.76
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 21.72
ACD/KOC (pH 7.4): 125.36
Polar Surface Area: 123 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 380.7±3.0 cm3

Click to predict properties on the Chemicalize site


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