ChemSpider 2D Image | 8-[(E)-2-Cyclopropylvinyl]-2-[(dimethylamino)methyl][1]benzothieno[3,2-d]pyrimidin-4(1H)-one | C18H19N3OS

8-[(E)-2-Cyclopropylvinyl]-2-[(dimethylamino)methyl][1]benzothieno[3,2-d]pyrimidin-4(1H)-one

  • Molecular FormulaC18H19N3OS
  • Average mass325.428 Da
  • Monoisotopic mass325.124878 Da
  • ChemSpider ID24639376

  • Double-bond stereo - Double-bond stereo

More details:

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

[1]Benzothieno[3,2-d]pyrimidin-4(3H)-one, 8-[(E)-2-cyclopropylethenyl]-2-[(dimethylamino)methyl]- [ACD/Index Name]
8-[(E)-2-cyclopropylethenyl]-2-[(dimethylamino)methyl][1]benzothieno[3,2-D]pyrimidin-4(3H)-one
8-[(E)-2-Cyclopropylvinyl]-2-[(dimethylamino)methyl][1]benzothieno[3,2-d]pyrimidin-4(1H)-on [German] [ACD/IUPAC Name]
8-[(E)-2-Cyclopropylvinyl]-2-[(dimethylamino)methyl][1]benzothieno[3,2-d]pyrimidin-4(1H)-one [ACD/IUPAC Name]
8-[(E)-2-Cyclopropylvinyl]-2-[(diméthylamino)méthyl][1]benzothiéno[3,2-d]pyrimidin-4(1H)-one [French] [ACD/IUPAC Name]
LXG

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.714
Molar Refractivity: 93.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 2.01
ACD/KOC (pH 5.5): 16.90
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 74.60
ACD/KOC (pH 7.4): 626.25
Polar Surface Area: 73 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 53.1±7.0 dyne/cm
Molar Volume: 238.6±7.0 cm3

Click to predict properties on the Chemicalize site


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