ChemSpider 2D Image | N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[5-(4-fluorophenyl)-2H-tetrazol-2-yl]-N-{2-[(3-methylbutyl)amino]-2-oxo-1-(2-thienyl)ethyl}acetamide | C28H29FN6O4S

N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[5-(4-fluorophenyl)-2H-tetrazol-2-yl]-N-{2-[(3-methylbutyl)amino]-2-oxo-1-(2-thienyl)ethyl}acetamide

  • Molecular FormulaC28H29FN6O4S
  • Average mass564.631 Da
  • Monoisotopic mass564.195496 Da
  • ChemSpider ID2430850

More details:

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

2H-Tetrazole-2-acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-fluorophenyl)-N-[2-[(3-methylbutyl)amino]-2-oxo-1-(2-thienyl)ethyl]- [ACD/Index Name]
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[5-(4-fluorophenyl)-2H-tetrazol-2-yl]-N-{2-[(3-methylbutyl)amino]-2-oxo-1-(2-thienyl)ethyl}acetamide [ACD/IUPAC Name]
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[5-(4-fluorophényl)-2H-tétrazol-2-yl]-N-{2-[(3-méthylbutyl)amino]-2-oxo-1-(2-thiényl)éthyl}acétamide [French] [ACD/IUPAC Name]
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[5-(4-fluorphenyl)-2H-tetrazol-2-yl]-N-{2-[(3-methylbutyl)amino]-2-oxo-1-(2-thienyl)ethyl}acetamid [German] [ACD/IUPAC Name]

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

ASN 03875186 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.670
Molar Refractivity: 150.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 225.26
ACD/KOC (pH 5.5): 1681.37
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 225.26
ACD/KOC (pH 7.4): 1681.38
Polar Surface Area: 140 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 53.8±7.0 dyne/cm
Molar Volume: 403.6±7.0 cm3

Click to predict properties on the Chemicalize site


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