ChemSpider 2D Image | N-(8-{[(5-{Bis[(~2~H_3_)methyl]amino}-1-naphthyl)sulfonyl]amino}octyl)-1-adamantanecarboxamide | C31H39D6N3O3S

N-(8-{[(5-{Bis[(2H3)methyl]amino}-1-naphthyl)sulfonyl]amino}octyl)-1-adamantanecarboxamide

  • Molecular FormulaC31H39D6N3O3S
  • Average mass545.809 Da
  • Monoisotopic mass545.355835 Da
  • ChemSpider ID52082761

  • Non-standard isotope - Non-standard isotope

More details:

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

N-(8-{[(5-{Bis[(2H3)methyl]amino}-1-naphthyl)sulfonyl]amino}octyl)-1-adamantancarboxamid [German] [ACD/IUPAC Name]
N-(8-{[(5-{Bis[(2H3)methyl]amino}-1-naphthyl)sulfonyl]amino}octyl)-1-adamantanecarboxamide [ACD/IUPAC Name]
N-(8-{[(5-{Bis[(2H3)méthyl]amino}-1-naphtyl)sulfonyl]amino}octyl)-1-adamantanecarboxamide [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-carboxamide, N-[8-[[[5-(dimethyl-d3-amino)-1-naphthalenyl]sulfonyl]amino]octyl]- [ACD/Index Name]
N-(8-Dansyl-d6 amino)octyl-1-adamantane carboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.596
Molar Refractivity: 155.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.92
ACD/LogD (pH 5.5): 6.23
ACD/BCF (pH 5.5): 31870.12
ACD/KOC (pH 5.5): 57967.18
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 32363.43
ACD/KOC (pH 7.4): 58864.45
Polar Surface Area: 87 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 456.9±3.0 cm3

Click to predict properties on the Chemicalize site


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