ChemSpider 2D Image | HDAC6 Inhibitor | C16H17N3O3

HDAC6 Inhibitor

  • Molecular FormulaC16H17N3O3
  • Average mass299.324 Da
  • Monoisotopic mass299.126984 Da
  • ChemSpider ID30835300

More details:

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

1259296-46-2 [RN]
6-Isoquinolinecarboxamide, 1,2,3,4-tetrahydro-N-hydroxy-2-[(1-methyl-1H-pyrrol-2-yl)carbonyl]- [ACD/Index Name]
HDAC6 Inhibitor
N-Hydroxy-2-(1-methyl-1H-pyrrole-2-carbonyl)-1,2,3,4-tetrahydroisoquinoline-6-carboxamide
N-Hydroxy-2-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-1,2,3,4-tetrahydro-6-isochinolincarboxamid [German] [ACD/IUPAC Name]
N-Hydroxy-2-[(1-méthyl-1H-pyrrol-2-yl)carbonyl]-1,2,3,4-tétrahydro-6-isoquinoléinecarboxamide [French] [ACD/IUPAC Name]
N-Hydroxy-2-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-1,2,3,4-tetrahydro-6-isoquinolinecarboxamide [ACD/IUPAC Name]
1,2,3,4-tetrahydro-N-hydroxy-2-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-6-isoquinolinecarboxamide
MFCD29770783
MPI_5a
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.660
    Molar Refractivity: 82.0±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -1.01
    ACD/LogD (pH 5.5): 0.22
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 31.28
    ACD/LogD (pH 7.4): 0.20
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 30.19
    Polar Surface Area: 75 Å2
    Polarizability: 32.5±0.5 10-24cm3
    Surface Tension: 55.3±7.0 dyne/cm
    Molar Volume: 221.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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