ChemSpider 2D Image | 1-{3-[4-(Diphenylmethyl)-1-piperazinyl]propyl}-3-(1H-imidazol-1-ylmethyl)-1H-indole-6-carboxylic acid | C33H35N5O2

1-{3-[4-(Diphenylmethyl)-1-piperazinyl]propyl}-3-(1H-imidazol-1-ylmethyl)-1H-indole-6-carboxylic acid

  • Molecular FormulaC33H35N5O2
  • Average mass533.663 Da
  • Monoisotopic mass533.279053 Da
  • ChemSpider ID117443

More details:

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

1-{3-[4-(Diphenylmethyl)-1-piperazinyl]propyl}-3-(1H-imidazol-1-ylmethyl)-1H-indol-6-carbonsäure [German] [ACD/IUPAC Name]
1-{3-[4-(Diphenylmethyl)-1-piperazinyl]propyl}-3-(1H-imidazol-1-ylmethyl)-1H-indole-6-carboxylic acid [ACD/IUPAC Name]
1H-Indole-6-carboxylic acid, 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-3-(1H-imidazol-1-ylmethyl)- [ACD/Index Name]
Acide 1-{3-[4-(diphénylméthyl)-1-pipérazinyl]propyl}-3-(1H-imidazol-1-ylméthyl)-1H-indole-6-carboxylique [French] [ACD/IUPAC Name]
1-(3-(4-BENZHYDRYL-(PIPERAZIN-1-YL))PROPYL)-3-(1H-IMIDAZOL-1-YLMETHYL)-1H-INDOLE-6-CARBOXYLIC ACID
1-(3-(4-Benzhydryl-1-piperazinyl)propyl)-3-(1H-imidazol-1-ylmethyl)-1H-indole-6-carboxylic acid
172544-75-1 [RN]

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

KY 234 [DBID]
KY-234 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 758.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.0±3.0 kJ/mol
Flash Point: 412.8±32.9 °C
Index of Refraction: 1.658
Molar Refractivity: 159.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.07
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 1.13
ACD/KOC (pH 5.5): 4.26
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 5.98
ACD/KOC (pH 7.4): 22.58
Polar Surface Area: 67 Å2
Polarizability: 63.4±0.5 10-24cm3
Surface Tension: 52.2±7.0 dyne/cm
Molar Volume: 434.3±7.0 cm3

Click to predict properties on the Chemicalize site


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