ChemSpider 2D Image | N-{3-[(1S,3S)-3-(Methylamino)cyclohexyl]-1H-indol-5-yl}-2-thiophenecarboximidamide | C20H24N4S

N-{3-[(1S,3S)-3-(Methylamino)cyclohexyl]-1H-indol-5-yl}-2-thiophenecarboximidamide

  • Molecular FormulaC20H24N4S
  • Average mass352.496 Da
  • Monoisotopic mass352.172180 Da
  • ChemSpider ID28526303

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2-Thiophenecarboximidamide, N-[3-[(1S,3S)-3-(methylamino)cyclohexyl]-1H-indol-5-yl]- [ACD/Index Name]
N-{3-[(1S,3S)-3-(Methylamino)cyclohexyl]-1H-indol-5-yl}-2-thiophencarboximidamid [German] [ACD/IUPAC Name]
N-{3-[(1S,3S)-3-(Methylamino)cyclohexyl]-1H-indol-5-yl}-2-thiophenecarboximidamide [ACD/IUPAC Name]
N-{3-[(1S,3S)-3-(Méthylamino)cyclohexyl]-1H-indol-5-yl}-2-thiophènecarboximidamide [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: 549.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 285.9±32.9 °C
Index of Refraction: 1.707
Molar Refractivity: 103.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 265.0±7.0 cm3

Click to predict properties on the Chemicalize site


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