ChemSpider 2D Image | 3-[4-Amino-3-(4-{[(3-methylphenyl)carbamoyl]amino}phenyl)thieno[3,2-c]pyridin-7-yl]-N-[2-(diethylamino)ethyl]acrylamide | C30H34N6O2S

3-[4-Amino-3-(4-{[(3-methylphenyl)carbamoyl]amino}phenyl)thieno[3,2-c]pyridin-7-yl]-N-[2-(diethylamino)ethyl]acrylamide

  • Molecular FormulaC30H34N6O2S
  • Average mass542.695 Da
  • Monoisotopic mass542.246399 Da
  • ChemSpider ID24809073

More details:

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

2-Propenamide, 3-[4-amino-3-[4-[[[(3-methylphenyl)amino]carbonyl]amino]phenyl]thieno[3,2-c]pyridin-7-yl]-N-[2-(diethylamino)ethyl]- [ACD/Index Name]
3-[4-Amino-3-(4-{[(3-methylphenyl)carbamoyl]amino}phenyl)thieno[3,2-c]pyridin-7-yl]-N-[2-(diethylamino)ethyl]acrylamid [German] [ACD/IUPAC Name]
3-[4-Amino-3-(4-{[(3-methylphenyl)carbamoyl]amino}phenyl)thieno[3,2-c]pyridin-7-yl]-N-[2-(diethylamino)ethyl]acrylamide [ACD/IUPAC Name]
3-[4-Amino-3-(4-{[(3-méthylphényl)carbamoyl]amino}phényl)thiéno[3,2-c]pyridin-7-yl]-N-[2-(diéthylamino)éthyl]acrylamide [French] [ACD/IUPAC Name]
Kinome_501

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

Density: 1.3±0.1 g/cm3
Boiling Point: 732.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.9±3.0 kJ/mol
Flash Point: 396.6±32.9 °C
Index of Refraction: 1.702
Molar Refractivity: 164.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 6.92
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 1.12
ACD/KOC (pH 5.5): 4.05
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 59.15
ACD/KOC (pH 7.4): 213.78
Polar Surface Area: 141 Å2
Polarizability: 65.0±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 423.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement