Found 2 results

Search term: MF = 'C_{30}H_{29}BrClFN_{4}O_{4}'
ChemSpider 2D Image | 4-({[4-Bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl}amino)-N-[2-(4-hydroxy-1-piperidinyl)ethyl]-3-methylbenzamide | C30H29BrClFN4O4

4-({[4-Bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl}amino)-N-[2-(4-hydroxy-1-piperidinyl)ethyl]-3-methylbenzamide

  • Molecular FormulaC30H29BrClFN4O4
  • Average mass643.931 Da
  • Monoisotopic mass642.104492 Da
  • ChemSpider ID17352887

More details:

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

4-({[4-Brom-3-(3-chlor-5-cyanphenoxy)-2-fluorphenyl]acetyl}amino)-N-[2-(4-hydroxy-1-piperidinyl)ethyl]-3-methylbenzamid [German] [ACD/IUPAC Name]
4-({[4-Bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl}amino)-N-[2-(4-hydroxy-1-piperidinyl)ethyl]-3-methylbenzamide [ACD/IUPAC Name]
4-({2-[4-Bromo-3-(3-chloro-5-cyanophénoxy)-2-fluorophényl]acétyl}amino)-N-[2-(4-hydroxy-1-pipéridinyl)éthyl]-3-méthylbenzamide [French] [ACD/IUPAC Name]
Benzeneacetamide, 4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluoro-N-[4-[[[2-(4-hydroxy-1-piperidinyl)ethyl]amino]carbonyl]-2-methylphenyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 769.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.5±3.0 kJ/mol
Flash Point: 419.1±32.9 °C
Index of Refraction: 1.662
Molar Refractivity: 157.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.53
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 7.26
ACD/KOC (pH 5.5): 28.94
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 369.61
ACD/KOC (pH 7.4): 1473.67
Polar Surface Area: 115 Å2
Polarizability: 62.2±0.5 10-24cm3
Surface Tension: 70.5±5.0 dyne/cm
Molar Volume: 424.1±5.0 cm3

Click to predict properties on the Chemicalize site


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