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Search term: NSKYYUZMAXEZIR-AQTBWJFISA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-{5-[(Z)-(5-Fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl}-3-(4-methyl-1-piperazinyl)propanamide | C23H28FN5O2

N-{5-[(Z)-(5-Fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl}-3-(4-methyl-1-piperazinyl)propanamide

  • Molecular FormulaC23H28FN5O2
  • Average mass425.499 Da
  • Monoisotopic mass425.222717 Da
  • ChemSpider ID34219512

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Piperazinepropanamide, N-[5-[(Z)-(5-fluoro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]-4-methyl- [ACD/Index Name]
N-{5-[(Z)-(5-Fluor-2-oxo-1,2-dihydro-3H-indol-3-yliden)methyl]-2,4-dimethyl-1H-pyrrol-3-yl}-3-(4-methyl-1-piperazinyl)propanamid [German] [ACD/IUPAC Name]
N-{5-[(Z)-(5-Fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl}-3-(4-methyl-1-piperazinyl)propanamide [ACD/IUPAC Name]
N-{5-[(Z)-(5-Fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidène)méthyl]-2,4-diméthyl-1H-pyrrol-3-yl}-3-(4-méthyl-1-pipérazinyl)propanamide [French] [ACD/IUPAC 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: 665.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.5±31.5 °C
Index of Refraction: 1.647
Molar Refractivity: 119.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): -0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.38
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 3.69
ACD/KOC (pH 7.4): 66.03
Polar Surface Area: 80 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 328.1±3.0 cm3

Click to predict properties on the Chemicalize site


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