ChemSpider 2D Image | 4-[(5-Chloro-1H-indol-2-yl)sulfonyl]-1-({1-[2-(dimethylamino)-4-pyrimidinyl]-4-piperidinyl}methyl)-2-piperazinone | C24H30ClN7O3S

4-[(5-Chloro-1H-indol-2-yl)sulfonyl]-1-({1-[2-(dimethylamino)-4-pyrimidinyl]-4-piperidinyl}methyl)-2-piperazinone

  • Molecular FormulaC24H30ClN7O3S
  • Average mass532.058 Da
  • Monoisotopic mass531.181946 Da
  • ChemSpider ID8112502

More details:

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

2-Piperazinone, 4-[(5-chloro-1H-indol-2-yl)sulfonyl]-1-[[1-[2-(dimethylamino)-4-pyrimidinyl]-4-piperidinyl]methyl]- [ACD/Index Name]
4-[(5-Chlor-1H-indol-2-yl)sulfonyl]-1-({1-[2-(dimethylamino)-4-pyrimidinyl]-4-piperidinyl}methyl)-2-piperazinon [German] [ACD/IUPAC Name]
4-[(5-Chloro-1H-indol-2-yl)sulfonyl]-1-({1-[2-(dimethylamino)-4-pyrimidinyl]-4-piperidinyl}methyl)-2-piperazinone [ACD/IUPAC Name]
4-[(5-Chloro-1H-indol-2-yl)sulfonyl]-1-({1-[2-(diméthylamino)-4-pyrimidinyl]-4-pipéridinyl}méthyl)-2-pipérazinone [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: 794.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.5±3.0 kJ/mol
Flash Point: 434.3±35.7 °C
Index of Refraction: 1.662
Molar Refractivity: 139.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.68
ACD/LogD (pH 7.4): 1.65
ACD/BCF (pH 7.4): 5.07
ACD/KOC (pH 7.4): 46.79
Polar Surface Area: 114 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 67.8±3.0 dyne/cm
Molar Volume: 376.5±3.0 cm3

Click to predict properties on the Chemicalize site


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