Found 1 result

Search term: RTOUKFMBOVMEOT-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(6-{2-[2-(2-Amino-3-{3-[(3,3-dimethylbutyl)amino]-3-oxopropyl}-6-quinolinyl)phenyl]ethyl}-3-pyridinyl)-4-fluorobenzamide | C38H40FN5O2

N-(6-{2-[2-(2-Amino-3-{3-[(3,3-dimethylbutyl)amino]-3-oxopropyl}-6-quinolinyl)phenyl]ethyl}-3-pyridinyl)-4-fluorobenzamide

  • Molecular FormulaC38H40FN5O2
  • Average mass617.755 Da
  • Monoisotopic mass617.316589 Da
  • ChemSpider ID58874265

More details:

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

3-Quinolinepropanamide, 2-amino-N-(3,3-dimethylbutyl)-6-[2-[2-[5-[(4-fluorobenzoyl)amino]-2-pyridinyl]ethyl]phenyl]- [ACD/Index Name]
N-(6-{2-[2-(2-Amino-3-{3-[(3,3-dimethylbutyl)amino]-3-oxopropyl}-6-chinolinyl)phenyl]ethyl}-3-pyridinyl)-4-fluorbenzamid [German] [ACD/IUPAC Name]
N-(6-{2-[2-(2-Amino-3-{3-[(3,3-diméthylbutyl)amino]-3-oxopropyl}-6-quinoléinyl)phényl]éthyl}-3-pyridinyl)-4-fluorobenzamide [French] [ACD/IUPAC Name]
N-(6-{2-[2-(2-Amino-3-{3-[(3,3-dimethylbutyl)amino]-3-oxopropyl}-6-quinolinyl)phenyl]ethyl}-3-pyridinyl)-4-fluorobenzamide [ACD/IUPAC Name]
N-(6-{2-[2-(2-Amino-3-{3-[(3,3-Dimethylbutyl)amino]-3-Oxopropyl}quinolin-6-Yl)phenyl]ethyl}pyridin-3-Yl)-4-Fluorobenzamide
68K

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

Density: 1.2±0.1 g/cm3
Boiling Point: 761.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.0±3.0 kJ/mol
Flash Point: 414.5±32.9 °C
Index of Refraction: 1.640
Molar Refractivity: 183.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.82
ACD/LogD (pH 5.5): 5.76
ACD/BCF (pH 5.5): 8115.83
ACD/KOC (pH 5.5): 11530.32
ACD/LogD (pH 7.4): 6.70
ACD/BCF (pH 7.4): 71074.24
ACD/KOC (pH 7.4): 100976.65
Polar Surface Area: 110 Å2
Polarizability: 72.7±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 508.5±3.0 cm3

Click to predict properties on the Chemicalize site


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