Found 218 results

Search term: MF = 'C_{20}H_{29}N_{5}O_{3}S_{2}'
ChemSpider 2D Image | N-Cyclohexyl-N-methyl-2-[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide | C20H29N5O3S2

N-Cyclohexyl-N-methyl-2-[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

  • Molecular FormulaC20H29N5O3S2
  • Average mass451.606 Da
  • Monoisotopic mass451.171173 Da
  • ChemSpider ID22236241

More details:

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

Acetamide, N-cyclohexyl-N-methyl-2-[[4-methyl-5-[[(methylsulfonyl)phenylamino]methyl]-4H-1,2,4-triazol-3-yl]thio]- [ACD/Index Name]
N-Cyclohexyl-N-methyl-2-[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
N-Cyclohexyl-N-methyl-2-[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide [ACD/IUPAC Name]
N-Cyclohexyl-N-méthyl-2-[(4-méthyl-5-{[(méthylsulfonyl)(phényl)amino]méthyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acétamide [French] [ACD/IUPAC Name]
N-Cyclohexyl-2-{5-[(methanesulfonyl-phenyl-amino)-methyl]-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl}-N-methyl-acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 657.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 351.5±34.3 °C
Index of Refraction: 1.643
Molar Refractivity: 122.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.62
ACD/KOC (pH 5.5): 510.62
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.62
ACD/KOC (pH 7.4): 510.63
Polar Surface Area: 122 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 53.0±7.0 dyne/cm
Molar Volume: 340.1±7.0 cm3

Click to predict properties on the Chemicalize site


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