Found 59 results

Search term: MF = 'C_{20}H_{30}N_{2}O_{7}S_{2}'
ChemSpider 2D Image | N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-[3-(4-morpholinyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide | C20H30N2O7S2

N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-[3-(4-morpholinyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

  • Molecular FormulaC20H30N2O7S2
  • Average mass474.591 Da
  • Monoisotopic mass474.149445 Da
  • ChemSpider ID32963068

More details:

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

2H-1,5-Benzodioxepin-7-sulfonamide, 3,4-dihydro-N-[3-(4-morpholinyl)propyl]-N-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-[3-(4-morpholinyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamid [German] [ACD/IUPAC Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-[3-(4-morpholinyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide [ACD/IUPAC Name]
N-(1,1-Dioxydotétrahydro-3-thiophényl)-N-[3-(4-morpholinyl)propyl]-3,4-dihydro-2H-1,5-benzodioxépine-7-sulfonamide [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: 687.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.8±3.0 kJ/mol
Flash Point: 369.8±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 116.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): -0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.32
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 5.81
ACD/KOC (pH 7.4): 109.91
Polar Surface Area: 119 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 65.4±5.0 dyne/cm
Molar Volume: 331.8±5.0 cm3

Click to predict properties on the Chemicalize site


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