Found 116 results

Search term: MF = 'C_{27}H_{25}Cl_{2}N_{3}O_{3}S'
ChemSpider 2D Image | 2-{[3-Cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide | C27H25Cl2N3O3S

2-{[3-Cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide

  • Molecular FormulaC27H25Cl2N3O3S
  • Average mass542.477 Da
  • Monoisotopic mass541.099365 Da
  • ChemSpider ID21672413

More details:

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

2-{[3-Cyan-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydro-2-chinolinyl]sulfanyl}-N-(3,5-dichlorphenyl)acetamid [German] [ACD/IUPAC Name]
2-{[3-Cyano-4-(4-méthoxyphényl)-7,7-diméthyl-5-oxo-1,4,5,6,7,8-hexahydro-2-quinoléinyl]sulfanyl}-N-(3,5-dichlorophényl)acétamide [French] [ACD/IUPAC Name]
2-{[3-Cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide [ACD/IUPAC Name]
Acetamide, 2-[[3-cyano-1,4,5,6,7,8-hexahydro-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-2-quinolinyl]thio]-N-(3,5-dichlorophenyl)- [ACD/Index Name]
2-[3-Cyano-4-(4-methoxy-phenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydro-quinolin-2-ylsulfanyl]-N-(3,5-dichloro-phenyl)-acetamide
2-{[3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 729.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.5±3.0 kJ/mol
Flash Point: 394.9±32.9 °C
Index of Refraction: 1.658
Molar Refractivity: 142.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.78
ACD/LogD (pH 5.5): 6.09
ACD/BCF (pH 5.5): 25127.83
ACD/KOC (pH 5.5): 49115.26
ACD/LogD (pH 7.4): 6.09
ACD/BCF (pH 7.4): 25127.64
ACD/KOC (pH 7.4): 49114.89
Polar Surface Area: 117 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 64.1±5.0 dyne/cm
Molar Volume: 387.1±5.0 cm3

Click to predict properties on the Chemicalize site


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