ChemSpider 2D Image | tert-butyl N-({6-[7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl]pyridin-3-yl}methyl)-N-(2-methoxyethyl)carbamate | C27H29FN4O4S

tert-butyl N-({6-[7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl]pyridin-3-yl}methyl)-N-(2-methoxyethyl)carbamate

  • Molecular FormulaC27H29FN4O4S
  • Average mass524.607 Da
  • Monoisotopic mass524.189331 Da
  • ChemSpider ID110416586

More details:

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

({6-[7-(4-Amino-2-fluorophénoxy)thiéno[3,2-b]pyridin-2-yl]-3-pyridinyl}méthyl)(2-méthoxyéthyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1123837-34-2 [RN]
2-Methyl-2-propanyl ({6-[7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl]-3-pyridinyl}methyl)(2-methoxyethyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-({6-[7-(4-amino-2-fluorphenoxy)thieno[3,2-b]pyridin-2-yl]-3-pyridinyl}methyl)(2-methoxyethyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[[6-[7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl]-3-pyridinyl]methyl]-N-(2-methoxyethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl N-({6-[7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl]pyridin-3-yl}methyl)-N-(2-methoxyethyl)carbamate
4-[[2-[5-[[Boc(2-methoxyethyl)amino]methyl]-2-pyridyl]-7-thieno[3,2-b]pyridyl]oxy]-3-fluoroaniline

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

Density: 1.3±0.1 g/cm3
Boiling Point: 670.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.1±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 143.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2448.07
ACD/KOC (pH 5.5): 9101.86
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2613.67
ACD/KOC (pH 7.4): 9717.55
Polar Surface Area: 128 Å2
Polarizability: 56.7±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 407.3±3.0 cm3

Click to predict properties on the Chemicalize site


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