ChemSpider 2D Image | N-(2-Fluoro-5-methylphenyl)-2-(17-methyl-6,13-dioxo-3,4,5,6,8,9,10,11,12,13-decahydro-1'H,2H-spiro[1,5,12-benzoxadiazacyclopentadecine-7,4'-piperidin]-1'-yl)acetamide | C30H39FN4O4

N-(2-Fluoro-5-methylphenyl)-2-(17-methyl-6,13-dioxo-3,4,5,6,8,9,10,11,12,13-decahydro-1'H,2H-spiro[1,5,12-benzoxadiazacyclopentadecine-7,4'-piperidin]-1'-yl)acetamide

  • Molecular FormulaC30H39FN4O4
  • Average mass538.654 Da
  • Monoisotopic mass538.295532 Da
  • ChemSpider ID80805712

More details:

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

N-(2-Fluor-5-methylphenyl)-2-(17-methyl-6,13-dioxo-3,4,5,6,8,9,10,11,12,13-decahydro-1'H,2H-spiro[1,5,12-benzoxadiazacyclopentadecine-7,4'-piperidin]-1'-yl)acetamid [German] [ACD/IUPAC Name]
N-(2-Fluoro-5-methylphenyl)-2-(17-methyl-6,13-dioxo-3,4,5,6,8,9,10,11,12,13-decahydro-1'H,2H-spiro[1,5,12-benzoxadiazacyclopentadecine-7,4'-piperidin]-1'-yl)acetamide [ACD/IUPAC Name]
N-(2-Fluoro-5-méthylphényl)-2-(17-méthyl-6,13-dioxo-3,4,5,6,8,9,10,11,12,13-décahydro-1'H,2H-spiro[1,5,12-benzoxadiazacyclopentadecine-7,4'-piperidin]-1'-yl)acétamide [French] [ACD/IUPAC Name]
Spiro[1,5,12-benzoxadiazacyclopentadecine-7(2H),4'-piperidine]-1'-acetamide, N-(2-fluoro-5-methylphenyl)-3,4,5,6,8,9,10,11,12,13-decahydro-17-methyl-6,13-dioxo- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 818.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 118.9±3.0 kJ/mol
Flash Point: 448.5±34.3 °C
Index of Refraction: 1.597
Molar Refractivity: 147.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 5.21
ACD/KOC (pH 5.5): 41.42
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 125.95
ACD/KOC (pH 7.4): 1000.72
Polar Surface Area: 100 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 55.6±5.0 dyne/cm
Molar Volume: 433.9±5.0 cm3

Click to predict properties on the Chemicalize site


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