ChemSpider 2D Image | N-Cyclohexyl-N~2~-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~2~-[({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfinyl)acetyl]glycinamide | C27H33N3O6S

N-Cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N2-[({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfinyl)acetyl]glycinamide

  • Molecular FormulaC27H33N3O6S
  • Average mass527.632 Da
  • Monoisotopic mass527.208984 Da
  • ChemSpider ID2441660

More details:

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

Acetamide, N-[2-(cyclohexylamino)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[2-[(4-methylphenyl)amino]-2-oxoethyl]sulfinyl]- [ACD/Index Name]
N-Cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N2-[({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfinyl)acetyl]glycinamid [German] [ACD/IUPAC Name]
N-Cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N2-[({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfinyl)acetyl]glycinamide [ACD/IUPAC Name]
N-Cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N2-[2-({2-[(4-méthylphényl)amino]-2-oxoéthyl}sulfinyl)acétyl]glycinamide [French] [ACD/IUPAC Name]

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

ASN 04618035 [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: 860.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 125.0±3.0 kJ/mol
Flash Point: 474.2±34.3 °C
Index of Refraction: 1.641
Molar Refractivity: 140.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 1.85
ACD/BCF (pH 5.5): 15.05
ACD/KOC (pH 5.5): 242.39
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 15.05
ACD/KOC (pH 7.4): 242.40
Polar Surface Area: 133 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 69.1±5.0 dyne/cm
Molar Volume: 389.9±5.0 cm3

Click to predict properties on the Chemicalize site


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