ChemSpider 2D Image | 2-[5-(1-Azepanylmethyl)-1H-tetrazol-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide | C20H27N7O

2-[5-(1-Azepanylmethyl)-1H-tetrazol-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide

  • Molecular FormulaC20H27N7O
  • Average mass381.475 Da
  • Monoisotopic mass381.227722 Da
  • ChemSpider ID22351806

More details:

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

1H-Tetrazole-1-acetamide, 5-[(hexahydro-1H-azepin-1-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]- [ACD/Index Name]
2-[5-(1-Azepanylmethyl)-1H-tetrazol-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamid [German] [ACD/IUPAC Name]
2-[5-(1-Azepanylmethyl)-1H-tetrazol-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide [ACD/IUPAC Name]
2-[5-(1-Azépanylméthyl)-1H-tétrazol-1-yl]-N-[2-(1H-indol-3-yl)éthyl]acétamide [French] [ACD/IUPAC 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: 716.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.7±3.0 kJ/mol
Flash Point: 387.0±32.9 °C
Index of Refraction: 1.694
Molar Refractivity: 108.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.09
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.65
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 7.51
ACD/KOC (pH 7.4): 141.04
Polar Surface Area: 92 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 57.9±7.0 dyne/cm
Molar Volume: 282.8±7.0 cm3

Click to predict properties on the Chemicalize site


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