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Search term: HBXAKQXZCKWFTQ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (4-{4-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}-1-piperidinyl)(1H-indazol-3-yl)methanone | C30H36N4O2S

(4-{4-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}-1-piperidinyl)(1H-indazol-3-yl)methanone

  • Molecular FormulaC30H36N4O2S
  • Average mass516.697 Da
  • Monoisotopic mass516.255920 Da
  • ChemSpider ID2816607

More details:

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

(4-{4-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}-1-piperidinyl)(1H-indazol-3-yl)methanon [German] [ACD/IUPAC Name]
(4-{4-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1,3-thiazol-2-yl}-1-piperidinyl)(1H-indazol-3-yl)methanone [ACD/IUPAC Name]
(4-{4-[4-Hydroxy-3,5-bis(2-méthyl-2-propanyl)phényl]-1,3-thiazol-2-yl}-1-pipéridinyl)(1H-indazol-3-yl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-[4-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-2-thiazolyl]-1-piperidinyl]-1H-indazol-3-yl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 682.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.7±3.0 kJ/mol
Flash Point: 366.4±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 150.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.57
ACD/LogD (pH 5.5): 5.86
ACD/BCF (pH 5.5): 16595.59
ACD/KOC (pH 5.5): 36493.96
ACD/LogD (pH 7.4): 5.85
ACD/BCF (pH 7.4): 16505.95
ACD/KOC (pH 7.4): 36296.84
Polar Surface Area: 110 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 424.2±3.0 cm3

Click to predict properties on the Chemicalize site


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