ChemSpider 2D Image | 2-Methyl-2-propanyl 2-[(4-{4-[(5-propyl-1,3-thiazol-2-yl)amino]-2-pyrimidinyl}-1-piperidinyl)carbonyl]-4-morpholinecarboxylate | C25H36N6O4S

2-Methyl-2-propanyl 2-[(4-{4-[(5-propyl-1,3-thiazol-2-yl)amino]-2-pyrimidinyl}-1-piperidinyl)carbonyl]-4-morpholinecarboxylate

  • Molecular FormulaC25H36N6O4S
  • Average mass516.656 Da
  • Monoisotopic mass516.251892 Da
  • ChemSpider ID80801847

More details:

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

2-[(4-{4-[(5-Propyl-1,3-thiazol-2-yl)amino]-2-pyrimidinyl}-1-pipéridinyl)carbonyl]-4-morpholinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-[(4-{4-[(5-propyl-1,3-thiazol-2-yl)amino]-2-pyrimidinyl}-1-piperidinyl)carbonyl]-4-morpholinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-[(4-{4-[(5-propyl-1,3-thiazol-2-yl)amino]-2-pyrimidinyl}-1-piperidinyl)carbonyl]-4-morpholincarboxylat [German] [ACD/IUPAC Name]
4-Morpholinecarboxylic acid, 2-[[4-[4-[(5-propyl-2-thiazolyl)amino]-2-pyrimidinyl]-1-piperidinyl]carbonyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 685.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 368.6±34.3 °C
Index of Refraction: 1.591
Molar Refractivity: 138.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.59
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 365.83
ACD/KOC (pH 5.5): 2366.37
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 372.69
ACD/KOC (pH 7.4): 2410.70
Polar Surface Area: 138 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 409.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement