ChemSpider 2D Image | 2-{[3-Cyano-4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-pyridinyl]sulfanyl}-N-(2-methyl-5-nitrophenyl)acetamide | C29H24N4O4S

2-{[3-Cyano-4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-pyridinyl]sulfanyl}-N-(2-methyl-5-nitrophenyl)acetamide

  • Molecular FormulaC29H24N4O4S
  • Average mass524.590 Da
  • Monoisotopic mass524.151855 Da
  • ChemSpider ID2381893

More details:

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

2-{[3-Cyan-4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-pyridinyl]sulfanyl}-N-(2-methyl-5-nitrophenyl)acetamid [German] [ACD/IUPAC Name]
2-{[3-Cyano-4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-pyridinyl]sulfanyl}-N-(2-methyl-5-nitrophenyl)acetamide [ACD/IUPAC Name]
2-{[3-Cyano-4-(4-méthoxyphényl)-6-(4-méthylphényl)-2-pyridinyl]sulfanyl}-N-(2-méthyl-5-nitrophényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[3-cyano-4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-pyridinyl]thio]-N-(2-methyl-5-nitrophenyl)- [ACD/Index Name]
2-{[3-CYANO-4-(4-METHOXYPHENYL)-6-(4-METHYLPHENYL)PYRIDIN-2-YL]SULFANYL}-N-(2-METHYL-5-NITROPHENYL)ACETAMIDE

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

BAS 01248102 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 740.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.0±3.0 kJ/mol
Flash Point: 401.5±32.9 °C
Index of Refraction: 1.682
Molar Refractivity: 145.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.13
ACD/LogD (pH 5.5): 6.21
ACD/BCF (pH 5.5): 30885.57
ACD/KOC (pH 5.5): 56931.30
ACD/LogD (pH 7.4): 6.21
ACD/BCF (pH 7.4): 30884.72
ACD/KOC (pH 7.4): 56929.73
Polar Surface Area: 146 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 72.2±5.0 dyne/cm
Molar Volume: 385.2±5.0 cm3

Click to predict properties on the Chemicalize site


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