Found 218 results

Search term: MF = 'C_{20}H_{29}N_{5}O_{3}S_{2}'
ChemSpider 2D Image | N-[(4-Ethyl-5-{[2-oxo-2-(1-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-N-(4-methylphenyl)methanesulfonamide | C20H29N5O3S2

N-[(4-Ethyl-5-{[2-oxo-2-(1-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-N-(4-methylphenyl)methanesulfonamide

  • Molecular FormulaC20H29N5O3S2
  • Average mass451.606 Da
  • Monoisotopic mass451.171173 Da
  • ChemSpider ID22955400

More details:

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

Methanesulfonamide, N-[[4-ethyl-5-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4H-1,2,4-triazol-3-yl]methyl]-N-(4-methylphenyl)- [ACD/Index Name]
N-[(4-Ethyl-5-{[2-oxo-2-(1-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-N-(4-methylphenyl)methanesulfonamide [ACD/IUPAC Name]
N-[(4-Éthyl-5-{[2-oxo-2-(1-pipéridinyl)éthyl]sulfanyl}-4H-1,2,4-triazol-3-yl)méthyl]-N-(4-méthylphényl)méthanesulfonamide [French] [ACD/IUPAC Name]
N-[(4-Ethyl-5-{[2-oxo-2-(1-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-N-(4-methylphenyl)methansulfonamid [German] [ACD/IUPAC Name]
N-[(4-ethyl-5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-N-(4-methylphenyl)methanesulfonamide
N-[4-Ethyl-5-(2-oxo-2-piperidin-1-yl-ethylsulfanyl)-4H-[1,2,4]triazol-3-ylmethyl]-N-p-tolyl-methanesulfonamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 683.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 367.4±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: 3.26
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 48.04
ACD/KOC (pH 5.5): 556.30
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 48.04
ACD/KOC (pH 7.4): 556.32
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


Advertisement