Found 76 results

Search term: MF = 'C_{16}H_{15}BrN_{2}OS_{2}'
ChemSpider 2D Image | 2-{1-[(2-Bromophenyl)sulfanyl]ethyl}-5,6-dimethylthieno[2,3-d]pyrimidin-4(1H)-one | C16H15BrN2OS2

2-{1-[(2-Bromophenyl)sulfanyl]ethyl}-5,6-dimethylthieno[2,3-d]pyrimidin-4(1H)-one

  • Molecular FormulaC16H15BrN2OS2
  • Average mass395.337 Da
  • Monoisotopic mass393.980896 Da
  • ChemSpider ID22073099

More details:

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

2-{1-[(2-Bromophenyl)sulfanyl]ethyl}-5,6-dimethylthieno[2,3-d]pyrimidin-4(1H)-one [ACD/IUPAC Name]
2-{1-[(2-Bromophényl)sulfanyl]éthyl}-5,6-diméthylthiéno[2,3-d]pyrimidin-4(1H)-one [French] [ACD/IUPAC Name]
2-{1-[(2-Bromphenyl)sulfanyl]ethyl}-5,6-dimethylthieno[2,3-d]pyrimidin-4(1H)-on [German] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidin-4(3H)-one, 2-[1-[(2-bromophenyl)thio]ethyl]-5,6-dimethyl- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.714
Molar Refractivity: 98.2±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.77
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1062.20
ACD/KOC (pH 5.5): 5101.96
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1062.01
ACD/KOC (pH 7.4): 5101.06
Polar Surface Area: 95 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 52.2±7.0 dyne/cm
Molar Volume: 250.3±7.0 cm3

Click to predict properties on the Chemicalize site


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