ChemSpider 2D Image | 2-Methyl-2-propanyl 4-{4-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}-1-piperidinecarboxylate | C24H28N6O5S

2-Methyl-2-propanyl 4-{4-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}-1-piperidinecarboxylate

  • Molecular FormulaC24H28N6O5S
  • Average mass512.581 Da
  • Monoisotopic mass512.184204 Da
  • ChemSpider ID22480228

More details:

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

1-Piperidinecarboxylic acid, 4-[4-[[(4-methyl-2-thiazolyl)amino]carbonyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-{4-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-{4-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-{4-[(4-Méthyl-1,3-thiazol-2-yl)carbamoyl]-1-(4-nitrophényl)-1H-pyrazol-5-yl}-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.675
Molar Refractivity: 136.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 683.22
ACD/KOC (pH 5.5): 3551.74
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 60.62
ACD/KOC (pH 7.4): 315.14
Polar Surface Area: 163 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 57.6±7.0 dyne/cm
Molar Volume: 362.9±7.0 cm3

Click to predict properties on the Chemicalize site


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