ChemSpider 2D Image | 1-(Isopropylsulfonyl)-3-[1-(1,3-thiazol-4-ylmethyl)-1H-imidazol-2-yl]piperidine | C15H22N4O2S2

1-(Isopropylsulfonyl)-3-[1-(1,3-thiazol-4-ylmethyl)-1H-imidazol-2-yl]piperidine

  • Molecular FormulaC15H22N4O2S2
  • Average mass354.491 Da
  • Monoisotopic mass354.118408 Da
  • ChemSpider ID29484992

More details:

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

1-(Isopropylsulfonyl)-3-[1-(1,3-thiazol-4-ylmethyl)-1H-imidazol-2-yl]piperidin [German] [ACD/IUPAC Name]
1-(Isopropylsulfonyl)-3-[1-(1,3-thiazol-4-ylmethyl)-1H-imidazol-2-yl]piperidine [ACD/IUPAC Name]
1-(Isopropylsulfonyl)-3-[1-(1,3-thiazol-4-ylméthyl)-1H-imidazol-2-yl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 1-[(1-methylethyl)sulfonyl]-3-[1-(4-thiazolylmethyl)-1H-imidazol-2-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 548.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.8±3.0 kJ/mol
Flash Point: 285.3±32.9 °C
Index of Refraction: 1.678
Molar Refractivity: 95.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.75
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 5.69
ACD/KOC (pH 7.4): 116.97
Polar Surface Area: 105 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 252.6±7.0 cm3

Click to predict properties on the Chemicalize site


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