ChemSpider 2D Image | N-(3-{4-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-8-quinolinesulfonamide | C34H37N3O7S

N-(3-{4-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-8-quinolinesulfonamide

  • Molecular FormulaC34H37N3O7S
  • Average mass631.739 Da
  • Monoisotopic mass631.235229 Da
  • ChemSpider ID3487021

More details:

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

8-Quinolinesulfonamide, N-[3-[4-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]- [ACD/Index Name]
N-(3-{4-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-8-chinolinsulfonamid [German] [ACD/IUPAC Name]
N-(3-{4-(1,4-Dioxa-8-azaspiro[4.5]déc-8-ylméthyl)-6-[4-(hydroxyméthyl)phényl]-1,3-dioxan-2-yl}phényl)-8-quinoléinesulfonamide [French] [ACD/IUPAC Name]
N-(3-{4-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-8-quinolinesulfonamide [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: 820.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.0±3.0 kJ/mol
Flash Point: 450.0±37.1 °C
Index of Refraction: 1.692
Molar Refractivity: 170.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 6.32
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 3.46
ACD/KOC (pH 5.5): 12.67
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 26.83
ACD/KOC (pH 7.4): 98.18
Polar Surface Area: 128 Å2
Polarizability: 67.5±0.5 10-24cm3
Surface Tension: 73.7±5.0 dyne/cm
Molar Volume: 444.9±5.0 cm3

Click to predict properties on the Chemicalize site


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