ChemSpider 2D Image | N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]indole-3-carboxamide | C27H33F3N4O3

N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]indole-3-carboxamide

  • Molecular FormulaC27H33F3N4O3
  • Average mass518.571 Da
  • Monoisotopic mass518.250488 Da
  • ChemSpider ID58540498

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1621862-70-1 [RN]
1H-Indole-3-carboxamide, N-[(1,2-dihydro-4-methoxy-6-methyl-2-oxo-3-pyridinyl)methyl]-2-methyl-1-[(1R)-1-[1-(2,2,2-trifluoroethyl)-4-piperidinyl]ethyl]- [ACD/Index Name]
N-[(4-Methoxy-6-methyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-2-methyl-1-{(1R)-1-[1-(2,2,2-trifluorethyl)-4-piperidinyl]ethyl}-1H-indol-3-carboxamid [German] [ACD/IUPAC Name]
N-[(4-Methoxy-6-methyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-2-methyl-1-{(1R)-1-[1-(2,2,2-trifluoroethyl)-4-piperidinyl]ethyl}-1H-indole-3-carboxamide [ACD/IUPAC Name]
N-[(4-Méthoxy-6-méthyl-2-oxo-1,2-dihydro-3-pyridinyl)méthyl]-2-méthyl-1-{(1R)-1-[1-(2,2,2-trifluoroéthyl)-4-pipéridinyl]éthyl}-1H-indole-3-carboxamide [French] [ACD/IUPAC Name]
N-[(4-methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-1H-indole-3-carboxamide
N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]indole-3-carboxamide
(R)-N-((4-Methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-2-methyl-1-(1-(1-(2,2,2-trifluoroethyl)piperidin-4-yl)ethyl)-1H-indole-3-carboxamide
5-Fluoro-2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile [ACD/IUPAC Name]
CPI-1205
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

455J2479FY [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 692.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 372.6±31.5 °C
Index of Refraction: 1.590
Molar Refractivity: 133.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 219.49
ACD/KOC (pH 5.5): 1526.90
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 287.34
ACD/KOC (pH 7.4): 1998.97
Polar Surface Area: 76 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 41.2±7.0 dyne/cm
Molar Volume: 395.2±7.0 cm3

Click to predict properties on the Chemicalize site


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