ChemSpider 2D Image | 2-(3,4-Dihydro-2(1H)-isoquinolinyl)-7-(4-fluorophenyl)thieno[3,2-d]pyrimidin-4(1H)-one | C21H16FN3OS

2-(3,4-Dihydro-2(1H)-isoquinolinyl)-7-(4-fluorophenyl)thieno[3,2-d]pyrimidin-4(1H)-one

  • Molecular FormulaC21H16FN3OS
  • Average mass377.435 Da
  • Monoisotopic mass377.099823 Da
  • ChemSpider ID25185648

More details:

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

2-(3,4-Dihydro-2(1H)-isochinolinyl)-7-(4-fluorphenyl)thieno[3,2-d]pyrimidin-4(1H)-on [German] [ACD/IUPAC Name]
2-(3,4-Dihydro-2(1H)-isoquinoléinyl)-7-(4-fluorophényl)thiéno[3,2-d]pyrimidin-4(1H)-one [French] [ACD/IUPAC Name]
2-(3,4-Dihydro-2(1H)-isoquinolinyl)-7-(4-fluorophenyl)thieno[3,2-d]pyrimidin-4(1H)-one [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidin-4(3H)-one, 2-(3,4-dihydro-2(1H)-isoquinolinyl)-7-(4-fluorophenyl)- [ACD/Index Name]
[1242956-33-7] [RN]
1242956-33-7 [RN]
2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-(4-fluorophenyl)-1H-thieno[3,2-d]pyrimidin-4-one
2-(3,4-Dihydro-1H-isoquinolin-2-yl)-7-(4-fluoro-phenyl)-3H-thieno[3,2-d]pyrimidin-4-one
2-(3,4-dihydroisoquinolin-2(1H)-yl)-7-(4-fluorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
7-(4-fluorophenyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)-3H,4H-thieno[3,2-d]pyrimidin-4-one
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.732
Molar Refractivity: 105.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 3.31
ACD/BCF (pH 5.5): 165.51
ACD/KOC (pH 5.5): 1117.95
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 7.34
ACD/KOC (pH 7.4): 49.58
Polar Surface Area: 73 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 56.4±7.0 dyne/cm
Molar Volume: 262.9±7.0 cm3

Click to predict properties on the Chemicalize site


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