Found 1 result

Search term: 1222998-36-8 (Found by approved synonym)
ChemSpider 2D Image | Torin 1 | C35H28F3N5O2

Torin 1

  • Molecular FormulaC35H28F3N5O2
  • Average mass607.624 Da
  • Monoisotopic mass607.219482 Da
  • ChemSpider ID26232175

More details:

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

1-[4-(4-propanoylpiperazin-1-yl)-3-(trifluoromethyl)phenyl]-9-(quinolin-3-yl)-1H,2H-benzo[h]1,6-naphthyridin-2-one
1-[4-(4-Propionyl-1-pipérazinyl)-3-(trifluorométhyl)phényl]-9-(3-quinoléinyl)benzo[h][1,6]naphtyridin-2(1H)-one [French] [ACD/IUPAC Name]
1-[4-(4-Propionyl-1-piperazinyl)-3-(trifluoromethyl)phenyl]-9-(3-quinolinyl)benzo[h][1,6]naphthyridin-2(1H)-one [ACD/IUPAC Name]
1222998-36-8 [RN]
9-(3-Chinolinyl)-1-[4-(4-propionyl-1-piperazinyl)-3-(trifluormethyl)phenyl]benzo[h][1,6]naphthyridin-2(1H)-on [German] [ACD/IUPAC Name]
Benzo[h]-1,6-naphthyridin-2(1H)-one, 1-[4-[4-(1-oxopropyl)-1-piperazinyl]-3-(trifluoromethyl)phenyl]-9-(3-quinolinyl)- [ACD/Index Name]
Torin 1
[1222998-36-8] [RN]
1-(4-(4-Propionylpip erazin-1-yl)-3-(trifluoromethyl)phenyl)-9-(quinolin-3-yl)benzoh1,6naphthyridin-2(1H)-one
1-(4-(4-propionylpiperazin-1-yl)-3-(trifluoromethyl)phenyl)-9-(quinolin-3-yl)benzo[h][1,6]naphthyridin-2(1H)-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
PubChem Substance ID 329825761 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 817.2±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.9 mmHg at 25°C
    Enthalpy of Vaporization: 118.8±3.0 kJ/mol
    Flash Point: 448.0±34.3 °C
    Index of Refraction: 1.663
    Molar Refractivity: 165.2±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 2
    ACD/LogP: 5.26
    ACD/LogD (pH 5.5): 4.97
    ACD/BCF (pH 5.5): 3485.49
    ACD/KOC (pH 5.5): 11784.69
    ACD/LogD (pH 7.4): 4.99
    ACD/BCF (pH 7.4): 3651.79
    ACD/KOC (pH 7.4): 12347.00
    Polar Surface Area: 70 Å2
    Polarizability: 65.5±0.5 10-24cm3
    Surface Tension: 57.4±3.0 dyne/cm
    Molar Volume: 445.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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