ChemSpider 2D Image | tert-Butyl 5-(4-methylpiperazin-1-yl)-1H-indole-1-carboxylate | C18H25N3O2

tert-Butyl 5-(4-methylpiperazin-1-yl)-1H-indole-1-carboxylate

  • Molecular FormulaC18H25N3O2
  • Average mass315.410 Da
  • Monoisotopic mass315.194672 Da
  • ChemSpider ID28421707

More details:






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

1H-Indole-1-carboxylic acid, 5-(4-methyl-1-piperazinyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 5-(4-methyl-1-piperazinyl)-1H-indole-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-5-(4-methyl-1-piperazinyl)-1H-indol-1-carboxylat [German] [ACD/IUPAC Name]
5-(4-Méthyl-1-pipérazinyl)-1H-indole-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
913388-48-4 [RN]
tert-Butyl 5-(4-methylpiperazin-1-yl)-1H-indole-1-carboxylate
[913388-48-4] [RN]
1-Boc-5-(4-methyl-1-piperazinyl)-1H-indole
2-(Piperazin-1-yl)isonicotinic acid
5-[[4-(4-Pyridinyl)-6-quinolinyl]methylene]-2,4-thiazolidenedione;GSK1059615
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 446.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 223.6±31.5 °C
Index of Refraction: 1.582
Molar Refractivity: 91.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.06
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 44.48
ACD/KOC (pH 7.4): 403.05
Polar Surface Area: 38 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 41.3±7.0 dyne/cm
Molar Volume: 274.9±7.0 cm3

Click to predict properties on the Chemicalize site






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