ChemSpider 2D Image | (S)-AM1241 | C22H22IN3O3

(S)-AM1241

  • Molecular FormulaC22H22IN3O3
  • Average mass503.333 Da
  • Monoisotopic mass503.070587 Da
  • ChemSpider ID29341487

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2-Iod-5-nitrophenyl)(1-{[(2S)-1-methyl-2-piperidinyl]methyl}-1H-indol-3-yl)methanon [German] [ACD/IUPAC Name]
(2-Iodo-5-nitrophenyl)(1-{[(2S)-1-methyl-2-piperidinyl]methyl}-1H-indol-3-yl)methanone [ACD/IUPAC Name]
(2-Iodo-5-nitrophényl)(1-{[(2S)-1-méthyl-2-pipéridinyl]méthyl}-1H-indol-3-yl)méthanone [French] [ACD/IUPAC Name]
(2-Iodo-5-nitrophenyl)[1-[[(2S)-1-methyl-2-piperidinyl]methyl]-1H-indol-3-yl]methanone
(S)-am-1241
(S)-AM1241
444912-53-2 [RN]
Methanone, (2-iodo-5-nitrophenyl)[1-[[(2S)-1-methyl-2-piperidinyl]methyl]-1H-indol-3-yl]- [ACD/Index Name]
(2-Iodo-5-nitrophenyl)(1-(((2S)-1-methyl-2-piperidinyl)methyl)-1H-indol-3-yl)-methanone
(2-iodo-5-nitrophenyl)[1-[[(2S)-1-methyl-2-piperidinyl]methyl]-1H-indol-3-yl]-methanone
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

I104X21I7C [DBID]
UNII:I104X21I7C [DBID]
UNII-I104X21I7C [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 630.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 335.2±31.5 °C
Index of Refraction: 1.696
Molar Refractivity: 120.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 2.89
ACD/KOC (pH 5.5): 9.99
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 18.56
ACD/KOC (pH 7.4): 64.11
Polar Surface Area: 71 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 56.4±7.0 dyne/cm
Molar Volume: 313.5±7.0 cm3

Click to predict properties on the Chemicalize site


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