ChemSpider 2D Image | (6Z)-2-(2-Furyl)-5-imino-6-(2-thienylmethylene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one | C14H8N4O2S2

(6Z)-2-(2-Furyl)-5-imino-6-(2-thienylmethylene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

  • Molecular FormulaC14H8N4O2S2
  • Average mass328.369 Da
  • Monoisotopic mass328.008881 Da
  • ChemSpider ID22824898

  • Double-bond stereo - Double-bond stereo

More details:

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

(6Z)-2-(2-Furyl)-5-imino-6-(2-thienylmethylen)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-on [German] [ACD/IUPAC Name]
(6Z)-2-(2-Furyl)-5-imino-6-(2-thienylmethylene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one [ACD/IUPAC Name]
(6Z)-2-(2-Furyl)-5-imino-6-(2-thiénylméthylène)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one [French] [ACD/IUPAC Name]
7H-1,3,4-Thiadiazolo[3,2-a]pyrimidin-7-one, 2-(2-furanyl)-5,6-dihydro-5-imino-6-(2-thienylmethylene)-, (6Z)- [ACD/Index Name]
2-(2-furyl)-5-imino-6-(2-thienylmethylene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one [ACD/IUPAC Name]
2-Furan-2-yl-5-imino-6-thiophen-2-ylmethylene-5,6-dihydro-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

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

Density: 1.7±0.1 g/cm3
Boiling Point: 472.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.6±3.0 kJ/mol
Flash Point: 239.6±31.5 °C
Index of Refraction: 1.852
Molar Refractivity: 86.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.57
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.30
ACD/KOC (pH 5.5): 341.56
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.30
ACD/KOC (pH 7.4): 341.56
Polar Surface Area: 136 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 80.5±7.0 dyne/cm
Molar Volume: 193.7±7.0 cm3

Click to predict properties on the Chemicalize site


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