ChemSpider 2D Image | Bizelesin | C43H36Cl2N8O5

Bizelesin

  • Molecular FormulaC43H36Cl2N8O5
  • Average mass815.703 Da
  • Monoisotopic mass814.218567 Da
  • ChemSpider ID54789

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,3-Bis(2-(((S)-1-(chloromethyl)-1,6-dihydro-5-hydroxy-8-methylbenzo[1,2-b:4,3-b']dipyrrol-3(2H)-yl)carbonyl)indol-5-yl)urea
1,3-Bis(2-{[(1S)-1-(chlormethyl)-5-hydroxy-8-methyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]carbonyl}-1H-indol-5-yl)harnstoff [German] [ACD/IUPAC Name]
1,3-Bis(2-{[(1S)-1-(chloromethyl)-5-hydroxy-8-methyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]carbonyl}-1H-indol-5-yl)urea [ACD/IUPAC Name]
1,3-Bis(2-{[(1S)-1-(chlorométhyl)-5-hydroxy-8-méthyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]carbonyl}-1H-indol-5-yl)urée [French] [ACD/IUPAC Name]
129655-21-6 [RN]
Bizelesin [USAN]
L0O9OBI87E
Urea, N,N'-bis[2-[[(1S)-1-(chloromethyl)-1,6-dihydro-5-hydroxy-8-methylpyrrolo[3,2-e]indol-3(2H)-yl]carbonyl]-1H-indol-5-yl]- [ACD/Index Name]
1,3-BIS({2-[(1S)-1-(CHLOROMETHYL)-5-HYDROXY-8-METHYL-1H,2H,3H,6H-PYRROLO[3,2-E]INDOLE-3-CARBONYL]-1H-INDOL-5-YL})UREA
1,3-BIS({2-[(1S)-1-(CHLOROMETHYL)-5-HYDROXY-8-METHYL-1H,2H,6H-PYRROLO[3,2-E]INDOLE-3-CARBONYL]-1H-INDOL-5-YL})UREA
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

7035 [DBID]
D03137 [DBID]
U 77779 [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.856
    Molar Refractivity: 228.2±0.3 cm3
    #H bond acceptors: 13
    #H bond donors: 8
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 3
    ACD/LogP: 2.80
    ACD/LogD (pH 5.5): 4.03
    ACD/BCF (pH 5.5): 678.35
    ACD/KOC (pH 5.5): 3698.93
    ACD/LogD (pH 7.4): 4.03
    ACD/BCF (pH 7.4): 677.62
    ACD/KOC (pH 7.4): 3694.94
    Polar Surface Area: 185 Å2
    Polarizability: 90.5±0.5 10-24cm3
    Surface Tension: 95.8±3.0 dyne/cm
    Molar Volume: 508.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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