ChemSpider 2D Image | N,N-Bis[(~2~H_3_)methyl]-2-{5-[(1-pyrrolidinylsulfonyl)methyl]-1H-indol-3-yl}ethanamine | C17H19D6N3O2S

N,N-Bis[(2H3)methyl]-2-{5-[(1-pyrrolidinylsulfonyl)methyl]-1H-indol-3-yl}ethanamine

  • Molecular FormulaC17H19D6N3O2S
  • Average mass341.501 Da
  • Monoisotopic mass341.204407 Da
  • ChemSpider ID23992864

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Indole-3-ethanamine, N,N-di(methyl-d3)-5-[(1-pyrrolidinylsulfonyl)methyl]- [ACD/Index Name]
N,N-Bis[(2H3)methyl]-2-{5-[(1-pyrrolidinylsulfonyl)methyl]-1H-indol-3-yl}ethanamin [German] [ACD/IUPAC Name]
N,N-Bis[(2H3)methyl]-2-{5-[(1-pyrrolidinylsulfonyl)methyl]-1H-indol-3-yl}ethanamine [ACD/IUPAC Name]
N,N-Bis[(2H3)méthyl]-2-{5-[(1-pyrrolidinylsulfonyl)méthyl]-1H-indol-3-yl}éthanamine [French] [ACD/IUPAC Name]
ALMOTRIPTAN-D6

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

Density: 1.3±0.1 g/cm3
Boiling Point: 538.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.6±3.0 kJ/mol
Flash Point: 279.6±32.9 °C
Index of Refraction: 1.634
Molar Refractivity: 94.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.69
Polar Surface Area: 65 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 58.9±5.0 dyne/cm
Molar Volume: 264.1±5.0 cm3

Click to predict properties on the Chemicalize site


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