Found 76 results

Search term: MF = 'C_{16}H_{15}BrN_{2}OS_{2}'
ChemSpider 2D Image | 2-[(2-Bromobenzyl)sulfanyl]-3,5,6-trimethylthieno[2,3-d]pyrimidin-4(3H)-one | C16H15BrN2OS2

2-[(2-Bromobenzyl)sulfanyl]-3,5,6-trimethylthieno[2,3-d]pyrimidin-4(3H)-one

  • Molecular FormulaC16H15BrN2OS2
  • Average mass395.337 Da
  • Monoisotopic mass393.980896 Da
  • ChemSpider ID24757855

More details:

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

2-[(2-Brombenzyl)sulfanyl]-3,5,6-trimethylthieno[2,3-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
2-[(2-Bromobenzyl)sulfanyl]-3,5,6-trimethylthieno[2,3-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
2-[(2-Bromobenzyl)sulfanyl]-3,5,6-triméthylthiéno[2,3-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidin-4(3H)-one, 2-[[(2-bromophenyl)methyl]thio]-3,5,6-trimethyl- [ACD/Index Name]
2-[(2-bromobenzyl)thio]-3,5,6-trimethylthieno[2,3-d]pyrimidin-4(3H)-one
2-[(2-bromophenyl)methylthio]-3,5,6-trimethyl-3-hydrothiopheno[2,3-d]pyrimidin-4-one
2-{[(2-bromophenyl)methyl]sulfanyl}-3,5,6-trimethyl-3H,4H-thieno[2,3-d]pyrimidin-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: 545.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.6±32.9 °C
Index of Refraction: 1.700
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 4.31
ACD/BCF (pH 5.5): 1109.45
ACD/KOC (pH 5.5): 5263.65
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 1109.45
ACD/KOC (pH 7.4): 5263.65
Polar Surface Area: 86 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 256.4±7.0 cm3

Click to predict properties on the Chemicalize site


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