Found 67 results

Search term: MF = 'C_{28}H_{28}ClN_{3}OS'
ChemSpider 2D Image | 2-{[4-(3-Chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-mesitylacetamide | C28H28ClN3OS

2-{[4-(3-Chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-mesitylacetamide

  • Molecular FormulaC28H28ClN3OS
  • Average mass490.059 Da
  • Monoisotopic mass489.164154 Da
  • ChemSpider ID28948836

More details:

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

2-{[4-(3-Chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-mesitylacetamide [ACD/IUPAC Name]
2-{[4-(3-Chlorophényl)-7,8-diméthyl-3H-1,5-benzodiazépin-2-yl]sulfanyl}-N-mésitylacétamide [French] [ACD/IUPAC Name]
2-{[4-(3-Chlorphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-mesitylacetamid [German] [ACD/IUPAC Name]
Acetamide, 2-[[4-(3-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]thio]-N-(2,4,6-trimethylphenyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 666.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.6±31.5 °C
Index of Refraction: 1.634
Molar Refractivity: 142.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 6.28
ACD/BCF (pH 5.5): 34757.04
ACD/KOC (pH 5.5): 61738.55
ACD/LogD (pH 7.4): 6.28
ACD/BCF (pH 7.4): 35178.13
ACD/KOC (pH 7.4): 62486.53
Polar Surface Area: 79 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 42.7±7.0 dyne/cm
Molar Volume: 399.7±7.0 cm3

Click to predict properties on the Chemicalize site


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