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Search term: CMOPUHDFFUAOMA-NRFANRHFSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-[5-[6-(methylamino)pyrazin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]benzamide | C26H31N7O2

N-[5-[6-(methylamino)pyrazin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]benzamide

  • Molecular FormulaC26H31N7O2
  • Average mass473.570 Da
  • Monoisotopic mass473.253937 Da
  • ChemSpider ID26346194

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzamide, N-[1,2-dihydro-5-[6-(methylamino)-2-pyrazinyl]-2-oxo-3-pyridinyl]-4-[(2S)-2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]- [ACD/Index Name]
N-{5-[6-(Methylamino)-2-pyrazinyl]-2-oxo-1,2-dihydro-3-pyridinyl}-4-[(2S)-2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]benzamid [German] [ACD/IUPAC Name]
N-{5-[6-(Methylamino)-2-pyrazinyl]-2-oxo-1,2-dihydro-3-pyridinyl}-4-[(2S)-2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]benzamide [ACD/IUPAC Name]
N-{5-[6-(Méthylamino)-2-pyrazinyl]-2-oxo-1,2-dihydro-3-pyridinyl}-4-[(2S)-2-(1-pyrrolidinylméthyl)-1-pyrrolidinyl]benzamide [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: 794.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.5±3.0 kJ/mol
Flash Point: 434.3±32.9 °C
Index of Refraction: 1.675
Molar Refractivity: 133.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.14
ACD/LogD (pH 5.5): -2.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 71.3±5.0 dyne/cm
Molar Volume: 354.8±5.0 cm3

Click to predict properties on the Chemicalize site


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