Found 217 results

Search term: MF = 'C_{21}H_{30}N_{4}O_{5}S_{2}'
ChemSpider 2D Image | N-{[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]methyl}-N-methyl-4-{2-[(methylsulfonyl)amino]ethyl}benzamide | C21H30N4O5S2

N-{[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]methyl}-N-methyl-4-{2-[(methylsulfonyl)amino]ethyl}benzamide

  • Molecular FormulaC21H30N4O5S2
  • Average mass482.617 Da
  • Monoisotopic mass482.165771 Da
  • ChemSpider ID21746052

More details:

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

Benzamide, N-[[3,5-dimethyl-1-(tetrahydro-1,1-dioxido-3-thienyl)-1H-pyrazol-4-yl]methyl]-N-methyl-4-[2-[(methylsulfonyl)amino]ethyl]- [ACD/Index Name]
N-{[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]methyl}-N-methyl-4-{2-[(methylsulfonyl)amino]ethyl}benzamid [German] [ACD/IUPAC Name]
N-{[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]methyl}-N-methyl-4-{2-[(methylsulfonyl)amino]ethyl}benzamide [ACD/IUPAC Name]
N-{[1-(1,1-Dioxydotétrahydro-3-thiophényl)-3,5-diméthyl-1H-pyrazol-4-yl]méthyl}-N-méthyl-4-{2-[(méthylsulfonyl)amino]éthyl}benzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 767.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.8±3.0 kJ/mol
Flash Point: 418.1±35.7 °C
Index of Refraction: 1.635
Molar Refractivity: 125.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -1.01
ACD/LogD (pH 5.5): 0.35
ACD/BCF (pH 5.5): 1.08
ACD/KOC (pH 5.5): 36.74
ACD/LogD (pH 7.4): 0.35
ACD/BCF (pH 7.4): 1.08
ACD/KOC (pH 7.4): 36.77
Polar Surface Area: 135 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 350.2±7.0 cm3

Click to predict properties on the Chemicalize site


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