ChemSpider 2D Image | 2-{(Z)-[(1-Benzyl-2-methyl-1H-indol-3-yl)methylene]amino}-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide | C32H29N3OS

2-{(Z)-[(1-Benzyl-2-methyl-1H-indol-3-yl)methylene]amino}-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

  • Molecular FormulaC32H29N3OS
  • Average mass503.657 Da
  • Monoisotopic mass503.203125 Da
  • ChemSpider ID81301624

  • Double-bond stereo - Double-bond stereo

More details:

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

2-{(Z)-[(1-Benzyl-2-methyl-1H-indol-3-yl)methylen]amino}-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-3-carboxamid [German] [ACD/IUPAC Name]
2-{(Z)-[(1-Benzyl-2-methyl-1H-indol-3-yl)methylene]amino}-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide [ACD/IUPAC Name]
2-{(Z)-[(1-Benzyl-2-méthyl-1H-indol-3-yl)méthylène]amino}-N-phényl-4,5,6,7-tétrahydro-1-benzothiophène-3-carboxamide [French] [ACD/IUPAC Name]
Benzo[b]thiophene-3-carboxamide, 4,5,6,7-tetrahydro-2-[[(1Z)-[2-methyl-1-(phenylmethyl)-1H-indol-3-yl]methylene]amino]-N-phenyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 702.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.8±3.0 kJ/mol
Flash Point: 378.4±32.9 °C
Index of Refraction: 1.677
Molar Refractivity: 153.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 7.96
ACD/LogD (pH 5.5): 7.35
ACD/BCF (pH 5.5): 227219.34
ACD/KOC (pH 5.5): 237333.25
ACD/LogD (pH 7.4): 7.35
ACD/BCF (pH 7.4): 227874.92
ACD/KOC (pH 7.4): 238018.00
Polar Surface Area: 75 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 50.0±7.0 dyne/cm
Molar Volume: 407.1±7.0 cm3

Click to predict properties on the Chemicalize site


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