ChemSpider 2D Image | Tert-Butyl 6-{[2-Chloro-4-(Dimethylcarbamoyl)phenyl]amino}-2-(1,3-Oxazol-5-Yl)-1h-Pyrrolo[3,2-C]pyridine-1-Carboxylate | C24H24ClN5O4

Tert-Butyl 6-{[2-Chloro-4-(Dimethylcarbamoyl)phenyl]amino}-2-(1,3-Oxazol-5-Yl)-1h-Pyrrolo[3,2-C]pyridine-1-Carboxylate

  • Molecular FormulaC24H24ClN5O4
  • Average mass481.931 Da
  • Monoisotopic mass481.151672 Da
  • ChemSpider ID31133709

More details:

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

1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid, 6-[[2-chloro-4-[(dimethylamino)carbonyl]phenyl]amino]-2-(5-oxazolyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 6-{[2-chloro-4-(dimethylcarbamoyl)phenyl]amino}-2-(1,3-oxazol-5-yl)-1H-pyrrolo[3,2-c]pyridine-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-6-{[2-chlor-4-(dimethylcarbamoyl)phenyl]amino}-2-(1,3-oxazol-5-yl)-1H-pyrrolo[3,2-c]pyridin-1-carboxylat [German] [ACD/IUPAC Name]
6-{[2-Chloro-4-(diméthylcarbamoyl)phényl]amino}-2-(1,3-oxazol-5-yl)-1H-pyrrolo[3,2-c]pyridine-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
Tert-Butyl 6-{[2-Chloro-4-(Dimethylcarbamoyl)phenyl]amino}-2-(1,3-Oxazol-5-Yl)-1h-Pyrrolo[3,2-C]pyridine-1-Carboxylate
X20

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

Density: 1.3±0.1 g/cm3
Boiling Point: 677.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.5±3.0 kJ/mol
Flash Point: 363.6±34.3 °C
Index of Refraction: 1.638
Molar Refractivity: 128.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 2.79
ACD/KOC (pH 5.5): 19.74
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 99.33
ACD/KOC (pH 7.4): 702.33
Polar Surface Area: 102 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 48.6±7.0 dyne/cm
Molar Volume: 358.1±7.0 cm3

Click to predict properties on the Chemicalize site


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