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Search term: MF = 'C_{26}H_{37}N_{5}O_{5}'

ChemSpider 2D Image | Methyl 5-[(1-acetyl-4-piperidinyl)amino]-3-[(2-methylbutanoyl)amino]-1-(tetrahydro-2-furanylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate | C26H37N5O5

Methyl 5-[(1-acetyl-4-piperidinyl)amino]-3-[(2-methylbutanoyl)amino]-1-(tetrahydro-2-furanylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate

  • Molecular FormulaC26H37N5O5
  • Average mass499.603 Da
  • Monoisotopic mass499.279480 Da
  • ChemSpider ID23068002

More details:






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

1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-[(1-acetyl-4-piperidinyl)amino]-3-[(2-methyl-1-oxobutyl)amino]-1-[(tetrahydro-2-furanyl)methyl]-, methyl ester [ACD/Index Name]
5-[(1-Acétyl-4-pipéridinyl)amino]-3-[(2-méthylbutanoyl)amino]-1-(tétrahydro-2-furanylméthyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-[(1-acetyl-4-piperidinyl)amino]-3-[(2-methylbutanoyl)amino]-1-(tetrahydro-2-furanylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate [ACD/IUPAC Name]
Methyl-5-[(1-acetyl-4-piperidinyl)amino]-3-[(2-methylbutanoyl)amino]-1-(tetrahydro-2-furanylmethyl)-1H-pyrrolo[2,3-b]pyridin-2-carboxylat [German] [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: 768.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.9±3.0 kJ/mol
Flash Point: 418.7±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 133.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.61
ACD/KOC (pH 5.5): 478.19
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.46
ACD/KOC (pH 7.4): 500.53
Polar Surface Area: 115 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 49.7±7.0 dyne/cm
Molar Volume: 373.6±7.0 cm3

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