ChemSpider 2D Image | 6-[({1-[(7,8-Dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-4-phenyl-4-piperidinyl}carbonyl)amino]hexanoic acid | C32H38N2O8

6-[({1-[(7,8-Dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-4-phenyl-4-piperidinyl}carbonyl)amino]hexanoic acid

  • Molecular FormulaC32H38N2O8
  • Average mass578.653 Da
  • Monoisotopic mass578.262817 Da
  • ChemSpider ID17471250

More details:






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

6-[({1-[(7,8-Dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-4-phenyl-4-piperidinyl}carbonyl)amino]hexanoic acid [ACD/IUPAC Name]
6-[({1-[(7,8-Dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-4-phenyl-4-piperidinyl}carbonyl)amino]hexansäure [German] [ACD/IUPAC Name]
Acide 6-[({1-[2-(7,8-diméthoxy-4-méthyl-2-oxo-2H-chromén-3-yl)acétyl]-4-phényl-4-pipéridinyl}carbonyl)amino]hexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 6-[[[1-[2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-4-phenyl-4-piperidinyl]carbonyl]amino]- [ACD/Index Name]
6-[[1-[2-(7,8-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]-4-phenylpiperidine-4-carbonyl]amino]hexanoic acid
879770-49-7 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 846.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 129.0±3.0 kJ/mol
Flash Point: 465.9±34.3 °C
Index of Refraction: 1.573
Molar Refractivity: 153.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 3.36
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 50.55
ACD/KOC (pH 5.5): 335.42
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.34
Polar Surface Area: 131 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 465.7±3.0 cm3

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