ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-1-(5-methyl-2-furyl)-2-oxoethyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide | C30H32N2O7

N-(1,3-Benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-1-(5-methyl-2-furyl)-2-oxoethyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide

  • Molecular FormulaC30H32N2O7
  • Average mass532.584 Da
  • Monoisotopic mass532.220947 Da
  • ChemSpider ID2439621

More details:

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

1,4-Benzodioxin-2-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-1-(5-methyl-2-furanyl)-2-oxoethyl]-2,3-dihydro- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-1-(5-methyl-2-furyl)-2-oxoethyl]-2,3-dihydro-1,4-benzodioxin-2-carboxamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-1-(5-methyl-2-furyl)-2-oxoethyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-N-[2-(cyclohexylamino)-1-(5-méthyl-2-furyl)-2-oxoéthyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide [French] [ACD/IUPAC Name]

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

ASN 04446838 [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: 736.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.4±3.0 kJ/mol
Flash Point: 399.2±32.9 °C
Index of Refraction: 1.639
Molar Refractivity: 142.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.82
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 262.20
ACD/KOC (pH 5.5): 1874.40
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 262.20
ACD/KOC (pH 7.4): 1874.40
Polar Surface Area: 99 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 63.2±5.0 dyne/cm
Molar Volume: 394.4±5.0 cm3

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