ChemSpider 2D Image | N-Isobutyl-N-(2-{4-[(2-methyl-1H-imidazo[4,5-c]pyridin-1-yl)methyl]-1-piperidinyl}-2-oxoethyl)-4-nitrobenzenesulfonamide | C25H32N6O5S

N-Isobutyl-N-(2-{4-[(2-methyl-1H-imidazo[4,5-c]pyridin-1-yl)methyl]-1-piperidinyl}-2-oxoethyl)-4-nitrobenzenesulfonamide

  • Molecular FormulaC25H32N6O5S
  • Average mass528.624 Da
  • Monoisotopic mass528.215515 Da
  • ChemSpider ID9289263

More details:

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

Benzenesulfonamide, N-[2-[4-[(2-methyl-1H-imidazo[4,5-c]pyridin-1-yl)methyl]-1-piperidinyl]-2-oxoethyl]-N-(2-methylpropyl)-4-nitro- [ACD/Index Name]
N-Isobutyl-N-(2-{4-[(2-methyl-1H-imidazo[4,5-c]pyridin-1-yl)methyl]-1-piperidinyl}-2-oxoethyl)-4-nitrobenzenesulfonamide [ACD/IUPAC Name]
N-Isobutyl-N-(2-{4-[(2-méthyl-1H-imidazo[4,5-c]pyridin-1-yl)méthyl]-1-pipéridinyl}-2-oxoéthyl)-4-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
N-Isobutyl-N-(2-{4-[(2-methyl-1H-imidazo[4,5-c]pyridin-1-yl)methyl]-1-piperidinyl}-2-oxoethyl)-4-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 756.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.2±3.0 kJ/mol
Flash Point: 411.1±35.7 °C
Index of Refraction: 1.660
Molar Refractivity: 141.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 16.67
ACD/KOC (pH 5.5): 116.38
ACD/LogD (pH 7.4): 3.45
ACD/BCF (pH 7.4): 234.64
ACD/KOC (pH 7.4): 1638.64
Polar Surface Area: 143 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 57.2±7.0 dyne/cm
Molar Volume: 382.5±7.0 cm3

Click to predict properties on the Chemicalize site


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