ChemSpider 2D Image | 2-[4-(3-Hydroxypropyl)-1-piperazinyl]ethyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate | C28H34ClN3O5

2-[4-(3-Hydroxypropyl)-1-piperazinyl]ethyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate

  • Molecular FormulaC28H34ClN3O5
  • Average mass528.040 Da
  • Monoisotopic mass527.218689 Da
  • ChemSpider ID112532

More details:






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

[1-(4-Chlorobenzoyl)-5-méthoxy-2-méthyl-1H-indol-3-yl]acétate de 2-[4-(3-hydroxypropyl)-1-pipérazinyl]éthyle [French] [ACD/IUPAC Name]
1h-indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 2-(4-(3-hydroxypropyl)-1-piperazinyl)ethyl ester
1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 2-[4-(3-hydroxypropyl)-1-piperazinyl]ethyl ester [ACD/Index Name]
2-[4-(3-Hydroxypropyl)-1-piperazinyl]ethyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate [ACD/IUPAC Name]
2-[4-(3-Hydroxypropyl)-1-piperazinyl]ethyl-[1-(4-chlorbenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetat [German] [ACD/IUPAC Name]
2-(4-(3-Hydroxypropyl)-1-piperazinyl)ethyl(1-(4-chlorobenzoyl)-5-methoxy-2-methyl)-3-indolylacetate
5410-01-5 [RN]
97460-20-3 [RN]
Desproglumideproglumetacin
DPPMT

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 630.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 335.0±31.5 °C
Index of Refraction: 1.607
Molar Refractivity: 142.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 1.06
ACD/BCF (pH 5.5): 1.43
ACD/KOC (pH 5.5): 14.32
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 46.18
ACD/KOC (pH 7.4): 463.77
Polar Surface Area: 84 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 47.9±7.0 dyne/cm
Molar Volume: 413.4±7.0 cm3

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