ChemSpider 2D Image | N-[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-(4-isobutoxyphenyl)-1H-pyrazol-5-yl]-2-(4-isopropylphenoxy)acetamide | C28H35N3O5S

N-[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-(4-isobutoxyphenyl)-1H-pyrazol-5-yl]-2-(4-isopropylphenoxy)acetamide

  • Molecular FormulaC28H35N3O5S
  • Average mass525.660 Da
  • Monoisotopic mass525.229736 Da
  • ChemSpider ID24759129

More details:

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

Acetamide, 2-[4-(1-methylethyl)phenoxy]-N-[3-[4-(2-methylpropoxy)phenyl]-1-(tetrahydro-1,1-dioxido-3-thienyl)-1H-pyrazol-5-yl]- [ACD/Index Name]
N-[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-(4-isobutoxyphenyl)-1H-pyrazol-5-yl]-2-(4-isopropylphenoxy)acetamid [German] [ACD/IUPAC Name]
N-[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-(4-isobutoxyphenyl)-1H-pyrazol-5-yl]-2-(4-isopropylphenoxy)acetamide [ACD/IUPAC Name]
N-[1-(1,1-Dioxydotétrahydro-3-thiophényl)-3-(4-isobutoxyphényl)-1H-pyrazol-5-yl]-2-(4-isopropylphénoxy)acétamide [French] [ACD/IUPAC Name]
1225175-61-0 [RN]
N-[1-(1,1-dioxidotetrahydro-3-thienyl)-3-(4-isobutoxyphenyl)-1H-pyrazol-5-yl]-2-(4-isopropylphenoxy)acetamide
N-[2-(1,1-dioxothiolan-3-yl)-5-[4-(2-methylpropoxy)phenyl]pyrazol-3-yl]-2-(4-propan-2-ylphenoxy)acetamide
N-{1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[4-(2-methylpropoxy)phenyl]-1H-pyrazol-5-yl}-2-[4-(propan-2-yl)phenoxy]acetamide
N-{1-(1,1-dioxothiolan-3-yl)-3-[4-(2-methylpropoxy)phenyl]pyrazol-5-yl}-2-[4-(methylethyl)phenoxy]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: 780.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.6±3.0 kJ/mol
Flash Point: 425.8±32.9 °C
Index of Refraction: 1.609
Molar Refractivity: 144.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 980.21
ACD/KOC (pH 5.5): 4817.08
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 980.24
ACD/KOC (pH 7.4): 4817.20
Polar Surface Area: 108 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 46.3±7.0 dyne/cm
Molar Volume: 416.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement