ChemSpider 2D Image | 9-[4-(Cyclohexyloxy)phenyl]-7-methyl-3,4-dihydropyrazino[2,1-c][1,2,4]thiadiazine 2,2-dioxide | C19H23N3O3S

9-[4-(Cyclohexyloxy)phenyl]-7-methyl-3,4-dihydropyrazino[2,1-c][1,2,4]thiadiazine 2,2-dioxide

  • Molecular FormulaC19H23N3O3S
  • Average mass373.469 Da
  • Monoisotopic mass373.146027 Da
  • ChemSpider ID81367230

More details:

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

2,2-Dioxyde de 9-[4-(cyclohexyloxy)phényl]-7-méthyl-3,4-dihydropyrazino[2,1-c][1,2,4]thiadiazine [French] [ACD/IUPAC Name]
9-[4-(Cyclohexyloxy)phenyl]-7-methyl-3,4-dihydropyrazino[2,1-c][1,2,4]thiadiazin-2,2-dioxid [German] [ACD/IUPAC Name]
9-[4-(Cyclohexyloxy)phenyl]-7-methyl-3,4-dihydropyrazino[2,1-c][1,2,4]thiadiazine 2,2-dioxide [ACD/IUPAC Name]
Pyrazino[2,1-c][1,2,4]thiadiazine, 9-[4-(cyclohexyloxy)phenyl]-3,4-dihydro-7-methyl-, 2,2-dioxide [ACD/Index Name]
1358751-06-0 [RN]
9-(4-cyclohexyloxyphenyl)-7-methyl-3,4-dihydropyrazino[2,1-c][1,2,4]thiadiazine 2,2-dioxide
9E3Toe5riz
TAK-653

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

Density: 1.4±0.1 g/cm3
Boiling Point: 540.8±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 280.9±30.7 °C
Index of Refraction: 1.669
Molar Refractivity: 100.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.10
ACD/KOC (pH 5.5): 407.53
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.11
ACD/KOC (pH 7.4): 407.59
Polar Surface Area: 80 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 54.6±7.0 dyne/cm
Molar Volume: 270.5±7.0 cm3

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