ChemSpider 2D Image | (3Z)-N-[2-Methyl-5-({4-[(4-methyl-1-piperazinyl)methyl]benzoyl}amino)phenyl]-2-oxo-3-(1H-pyrrol-2-ylmethylene)-6-indolinecarboxamide | C34H34N6O3

(3Z)-N-[2-Methyl-5-({4-[(4-methyl-1-piperazinyl)methyl]benzoyl}amino)phenyl]-2-oxo-3-(1H-pyrrol-2-ylmethylene)-6-indolinecarboxamide

  • Molecular FormulaC34H34N6O3
  • Average mass574.672 Da
  • Monoisotopic mass574.269226 Da
  • ChemSpider ID9831823

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-N-[2-Methyl-5-({4-[(4-methyl-1-piperazinyl)methyl]benzoyl}amino)phenyl]-2-oxo-3-(1H-pyrrol-2-ylmethylen)-6-indolincarboxamid [German] [ACD/IUPAC Name]
(3Z)-N-[2-Methyl-5-({4-[(4-methyl-1-piperazinyl)methyl]benzoyl}amino)phenyl]-2-oxo-3-(1H-pyrrol-2-ylmethylene)-6-indolinecarboxamide [ACD/IUPAC Name]
(3Z)-N-[2-Méthyl-5-({4-[(4-méthyl-1-pipérazinyl)méthyl]benzoyl}amino)phényl]-2-oxo-3-(1H-pyrrol-2-ylméthylène)-6-indolinecarboxamide [French] [ACD/IUPAC Name]
1H-Indole-6-carboxamide, 2,3-dihydro-N-[2-methyl-5-[[4-[(4-methyl-1-piperazinyl)methyl]benzoyl]amino]phenyl]-2-oxo-3-(1H-pyrrol-2-ylmethylene)-, (3Z)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 703.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.9±3.0 kJ/mol
Flash Point: 379.2±32.9 °C
Index of Refraction: 1.721
Molar Refractivity: 169.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.81
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 1.32
ACD/KOC (pH 5.5): 11.13
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 58.50
ACD/KOC (pH 7.4): 492.37
Polar Surface Area: 110 Å2
Polarizability: 67.2±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 428.6±3.0 cm3

Click to predict properties on the Chemicalize site


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