ChemSpider 2D Image | N-{[5-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]carbonyl}methionine | C11H14ClN3O3S2

N-{[5-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]carbonyl}methionine

  • Molecular FormulaC11H14ClN3O3S2
  • Average mass335.830 Da
  • Monoisotopic mass335.016510 Da
  • ChemSpider ID24758987

More details:

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

Methionine, N-[[5-chloro-2-(methylthio)-4-pyrimidinyl]carbonyl]- [ACD/Index Name]
N-{[5-Chlor-2-(methylsulfanyl)-4-pyrimidinyl]carbonyl}methionin [German] [ACD/IUPAC Name]
N-{[5-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]carbonyl}methionine [ACD/IUPAC Name]
N-{[5-Chloro-2-(méthylsulfanyl)-4-pyrimidinyl]carbonyl}méthionine [French] [ACD/IUPAC Name]
2-(5-chloro-2-(methylthio)pyrimidine-4-carboxamido)-4-(methylthio)butanoic acid
2-[(5-chloro-2-methylthiopyrimidin-4-yl)carbonylamino]-4-methylthiobutanoic ac id
2-[(5-chloro-2-methylthiopyrimidin-4-yl)carbonylamino]-4-methylthiobutanoic acid
2-{[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]formamido}-4-(methylsulfanyl)butanoic acid
N-{[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]carbonyl}methionine

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

Density: 1.5±0.1 g/cm3
Boiling Point: 605.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 319.7±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 81.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): -1.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 143 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 72.6±5.0 dyne/cm
Molar Volume: 229.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement