ChemSpider 2D Image | N-(3-{4-[(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-N'-hydroxyhexanediamide | C35H43N3O8

N-(3-{4-[(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-N'-hydroxyhexanediamide

  • Molecular FormulaC35H43N3O8
  • Average mass633.731 Da
  • Monoisotopic mass633.304993 Da
  • ChemSpider ID4312844

More details:

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

Hexanediamide, N1-[3-[4-[(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]-N6-hydroxy- [ACD/Index Name]
N-(3-{4-[(6,7-Dimethoxy-3,4-dihydro-2(1H)-isochinolinyl)methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-N'-hydroxyhexandiamid [German] [ACD/IUPAC Name]
N-(3-{4-[(6,7-Diméthoxy-3,4-dihydro-2(1H)-isoquinoléinyl)méthyl]-6-[4-(hydroxyméthyl)phényl]-1,3-dioxan-2-yl}phényl)-N'-hydroxyhexanediamide [French] [ACD/IUPAC Name]
N-(3-{4-[(6,7-Dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl)methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-N'-hydroxyhexanediamide [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 173.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 1.56
ACD/KOC (pH 5.5): 17.93
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 35.16
ACD/KOC (pH 7.4): 403.60
Polar Surface Area: 139 Å2
Polarizability: 68.6±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 502.2±3.0 cm3

Click to predict properties on the Chemicalize site


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