ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-N-(2-chlorobenzyl)-4-[(2-methyl-1-piperidinyl)sulfonyl]benzenesulfonamide | C27H29ClN2O6S2

N-(1,3-Benzodioxol-5-ylmethyl)-N-(2-chlorobenzyl)-4-[(2-methyl-1-piperidinyl)sulfonyl]benzenesulfonamide

  • Molecular FormulaC27H29ClN2O6S2
  • Average mass577.112 Da
  • Monoisotopic mass576.115540 Da
  • ChemSpider ID2441048

More details:

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

Benzenesulfonamide, N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-chlorophenyl)methyl]-4-[(2-methyl-1-piperidinyl)sulfonyl]- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-N-(2-chlorbenzyl)-4-[(2-methyl-1-piperidinyl)sulfonyl]benzolsulfonamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-N-(2-chlorobenzyl)-4-[(2-methyl-1-piperidinyl)sulfonyl]benzenesulfonamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-N-(2-chlorobenzyl)-4-[(2-méthyl-1-pipéridinyl)sulfonyl]benzènesulfonamide [French] [ACD/IUPAC Name]

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

ASN 04467630 [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: 723.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.7±3.0 kJ/mol
Flash Point: 391.3±35.7 °C
Index of Refraction: 1.629
Molar Refractivity: 147.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.02
ACD/LogD (pH 5.5): 5.86
ACD/BCF (pH 5.5): 16605.98
ACD/KOC (pH 5.5): 36513.40
ACD/LogD (pH 7.4): 5.86
ACD/BCF (pH 7.4): 16605.98
ACD/KOC (pH 7.4): 36513.40
Polar Surface Area: 110 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 414.8±3.0 cm3

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