ChemSpider 2D Image | N-(4-[5-(2-Amino-1-phenyl-2-propanyl)-1,3,4-oxadiazol-2-yl]-3-chloro-6-{(2-methoxyethyl)[(2-methylcyclopropyl)methyl]amino}-2-pyridinyl)-N-methylmethanesulfonamide | C26H35ClN6O4S

N-(4-[5-(2-Amino-1-phenyl-2-propanyl)-1,3,4-oxadiazol-2-yl]-3-chloro-6-{(2-methoxyethyl)[(2-methylcyclopropyl)methyl]amino}-2-pyridinyl)-N-methylmethanesulfonamide

  • Molecular FormulaC26H35ClN6O4S
  • Average mass563.112 Da
  • Monoisotopic mass562.212891 Da
  • ChemSpider ID22377485

More details:






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

Methanesulfonamide, N-[4-[5-(1-amino-1-methyl-2-phenylethyl)-1,3,4-oxadiazol-2-yl]-3-chloro-6-[(2-methoxyethyl)[(2-methylcyclopropyl)methyl]amino]-2-pyridinyl]-N-methyl- [ACD/Index Name]
N-(4-[5-(2-Amino-1-phenyl-2-propanyl)-1,3,4-oxadiazol-2-yl]-3-chlor-6-{(2-methoxyethyl)[(2-methylcyclopropyl)methyl]amino}-2-pyridinyl)-N-methylmethansulfonamid [German] [ACD/IUPAC Name]
N-(4-[5-(2-Amino-1-phenyl-2-propanyl)-1,3,4-oxadiazol-2-yl]-3-chloro-6-{(2-methoxyethyl)[(2-methylcyclopropyl)methyl]amino}-2-pyridinyl)-N-methylmethanesulfonamide [ACD/IUPAC Name]
N-(4-[5-(2-Amino-1-phényl-2-propanyl)-1,3,4-oxadiazol-2-yl]-3-chloro-6-{(2-méthoxyéthyl)[(2-méthylcyclopropyl)méthyl]amino}-2-pyridinyl)-N-méthylméthanesulfonamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 729.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.5±3.0 kJ/mol
Flash Point: 395.2±35.7 °C
Index of Refraction: 1.600
Molar Refractivity: 146.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 1.67
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 11.39
ACD/KOC (pH 5.5): 140.86
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 37.01
ACD/KOC (pH 7.4): 457.77
Polar Surface Area: 136 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 57.2±3.0 dyne/cm
Molar Volume: 429.3±3.0 cm3

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