ChemSpider 2D Image | N-{3-[(Mesitylcarbamoyl)amino]-2-naphthoyl}-O-(2-methyl-2-propanyl)-L-threonine | C29H35N3O5

N-{3-[(Mesitylcarbamoyl)amino]-2-naphthoyl}-O-(2-methyl-2-propanyl)-L-threonine

  • Molecular FormulaC29H35N3O5
  • Average mass505.605 Da
  • Monoisotopic mass505.257660 Da
  • ChemSpider ID24696110

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Threonine, O-(1,1-dimethylethyl)-N-[[3-[[[(2,4,6-trimethylphenyl)amino]carbonyl]amino]-2-naphthalenyl]carbonyl]- [ACD/Index Name]
N-{3-[(Mesitylcarbamoyl)amino]-2-naphthoyl}-O-(2-methyl-2-propanyl)-L-threonin [German] [ACD/IUPAC Name]
N-{3-[(Mesitylcarbamoyl)amino]-2-naphthoyl}-O-(2-methyl-2-propanyl)-L-threonine [ACD/IUPAC Name]
N-{3-[(Mésitylcarbamoyl)amino]-2-naphtoyl}-O-(2-méthyl-2-propanyl)-L-thréonine [French] [ACD/IUPAC Name]
O-Tert-Butyl-N-[(3-{[(2,4,6-Trimethylphenyl)carbamoyl]amino}naphthalen-2-Yl)carbonyl]-L-Threonine
26B
anthranilimide based compound, 2

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

Density: 1.2±0.1 g/cm3
Boiling Point: 634.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 337.6±31.5 °C
Index of Refraction: 1.633
Molar Refractivity: 146.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.93
ACD/LogD (pH 5.5): 3.47
ACD/BCF (pH 5.5): 71.24
ACD/KOC (pH 5.5): 162.88
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 3.44
ACD/KOC (pH 7.4): 7.87
Polar Surface Area: 117 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 410.5±3.0 cm3

Click to predict properties on the Chemicalize site


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