ChemSpider 2D Image | {1-[(3,4-Dimethoxyphenyl)sulfonyl]-4-piperidinyl}[4-(tetrahydro-2-furanylmethyl)-1,4-diazepan-1-yl]methanone | C24H37N3O6S

{1-[(3,4-Dimethoxyphenyl)sulfonyl]-4-piperidinyl}[4-(tetrahydro-2-furanylmethyl)-1,4-diazepan-1-yl]methanone

  • Molecular FormulaC24H37N3O6S
  • Average mass495.632 Da
  • Monoisotopic mass495.240295 Da
  • ChemSpider ID22402309

More details:

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

{1-[(3,4-Dimethoxyphenyl)sulfonyl]-4-piperidinyl}[4-(tetrahydro-2-furanylmethyl)-1,4-diazepan-1-yl]methanon [German] [ACD/IUPAC Name]
{1-[(3,4-Dimethoxyphenyl)sulfonyl]-4-piperidinyl}[4-(tetrahydro-2-furanylmethyl)-1,4-diazepan-1-yl]methanone [ACD/IUPAC Name]
{1-[(3,4-Diméthoxyphényl)sulfonyl]-4-pipéridinyl}[4-(tétrahydro-2-furanylméthyl)-1,4-diazépan-1-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, [1-[(3,4-dimethoxyphenyl)sulfonyl]-4-piperidinyl][hexahydro-4-[(tetrahydro-2-furanyl)methyl]-1H-1,4-diazepin-1-yl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 663.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.8±34.3 °C
Index of Refraction: 1.562
Molar Refractivity: 129.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.52
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 14.46
ACD/KOC (pH 7.4): 203.54
Polar Surface Area: 97 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 399.8±3.0 cm3

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