Found 1 result

Search term: RBEMAOJJWMNWMV (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 5-{4-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-1-piperazinyl}-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione | C16H23N5O5S

5-{4-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-1-piperazinyl}-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC16H23N5O5S
  • Average mass397.449 Da
  • Monoisotopic mass397.141998 Da
  • ChemSpider ID28957141

More details:






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

2,4(1H,3H)-Pyrimidinedione, 5-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]-1,3,6-trimethyl- [ACD/Index Name]
5-{4-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-1-piperazinyl}-1,3,6-trimethyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
5-{4-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-1-piperazinyl}-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-{4-[(3,5-Diméthyl-1,2-oxazol-4-yl)sulfonyl]-1-pipérazinyl}-1,3,6-triméthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
5-{4-[(3,5-dimethylisoxazol-4-yl)sulfonyl]piperazin-1-yl}-1,3,6-trimethylpyrimidine-2,4(1H,3H)-dione

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 567.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.2±3.0 kJ/mol
Flash Point: 296.8±32.9 °C
Index of Refraction: 1.588
Molar Refractivity: 97.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 1.63
ACD/LogD (pH 5.5): 1.01
ACD/BCF (pH 5.5): 3.45
ACD/KOC (pH 5.5): 84.54
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 3.46
ACD/KOC (pH 7.4): 84.56
Polar Surface Area: 116 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 288.9±3.0 cm3

Click to predict properties on the Chemicalize site






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