Found 312 results

Search term: MF = 'C_{21}H_{17}F_{3}N_{4}O_{2}S'
ChemSpider 2D Image | 7-(2-Furyl)-2-(1-pyrrolidinyl)-5-[4-(trifluoromethyl)benzyl][1,3]thiazolo[4,5-d]pyridazin-4(5H)-one | C21H17F3N4O2S

7-(2-Furyl)-2-(1-pyrrolidinyl)-5-[4-(trifluoromethyl)benzyl][1,3]thiazolo[4,5-d]pyridazin-4(5H)-one

  • Molecular FormulaC21H17F3N4O2S
  • Average mass446.445 Da
  • Monoisotopic mass446.102417 Da
  • ChemSpider ID22530588

More details:

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

7-(2-Furyl)-2-(1-pyrrolidinyl)-5-[4-(trifluormethyl)benzyl][1,3]thiazolo[4,5-d]pyridazin-4(5H)-on [German] [ACD/IUPAC Name]
7-(2-Furyl)-2-(1-pyrrolidinyl)-5-[4-(trifluoromethyl)benzyl][1,3]thiazolo[4,5-d]pyridazin-4(5H)-one [ACD/IUPAC Name]
7-(2-Furyl)-2-(1-pyrrolidinyl)-5-[4-(trifluorométhyl)benzyl][1,3]thiazolo[4,5-d]pyridazin-4(5H)-one [French] [ACD/IUPAC Name]
Thiazolo[4,5-d]pyridazin-4(5H)-one, 7-(2-furanyl)-2-(1-pyrrolidinyl)-5-[[4-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
1105240-57-0 [RN]
7-(furan-2-yl)-2-(pyrrolidin-1-yl)-5-(4-(trifluoromethyl)benzyl)thiazolo[4,5-d]pyridazin-4(5H)-one
7-(furan-2-yl)-2-(pyrrolidin-1-yl)-5-{[4-(trifluoromethyl)phenyl]methyl}-4H,5H-[1,3]thiazolo[4,5-d]pyridazin-4-one

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

Density: 1.5±0.1 g/cm3
Boiling Point: 584.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 307.2±32.9 °C
Index of Refraction: 1.686
Molar Refractivity: 110.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 286.70
ACD/KOC (pH 5.5): 1998.11
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 286.73
ACD/KOC (pH 7.4): 1998.33
Polar Surface Area: 90 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 53.8±7.0 dyne/cm
Molar Volume: 291.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement