Found 1 result

Search term: 1095382-05-0 (Found by approved synonym)
ChemSpider 2D Image | 6-Bromo-7-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinyl]-2-[4-(4-methyl-1-piperazinyl)phenyl]-3H-imidazo[4,5-b]pyridine | C26H31BrN8O

6-Bromo-7-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinyl]-2-[4-(4-methyl-1-piperazinyl)phenyl]-3H-imidazo[4,5-b]pyridine

  • Molecular FormulaC26H31BrN8O
  • Average mass551.481 Da
  • Monoisotopic mass550.180420 Da
  • ChemSpider ID25061218

More details:

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

1-[4-(6-bromo-7-{4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl}-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-4-methylpiperazine
1095382-05-0 [RN]
1H-Imidazo[4,5-b]pyridine, 6-bromo-7-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinyl]-2-[4-(4-methyl-1-piperazinyl)phenyl]- [ACD/Index Name]
6-Brom-7-{4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-piperazinyl}-2-[4-(4-methyl-1-piperazinyl)phenyl]-1H-imidazo[4,5-b]pyridin [German] [ACD/IUPAC Name]
6-Bromo-7-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinyl]-2-[4-(4-methyl-1-piperazinyl)phenyl]-3H-imidazo[4,5-b]pyridine
6-Bromo-7-{4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-piperazinyl}-2-[4-(4-methyl-1-piperazinyl)phenyl]-1H-imidazo[4,5-b]pyridine [ACD/IUPAC Name]
6-Bromo-7-{4-[(5-méthyl-1,2-oxazol-3-yl)méthyl]-1-pipérazinyl}-2-[4-(4-méthyl-1-pipérazinyl)phényl]-1H-imidazo[4,5-b]pyridine [French] [ACD/IUPAC Name]
6-Bromo-7-{4-[(5-Methylisoxazol-3-Yl)methyl]piperazin-1-Yl}-2-[4-(4-Methylpiperazin-1-Yl)phenyl]-1h-Imidazo[4,5-B]pyridine
MFCD18206879 [MDL number]
1-{6-bromo-2-[4-(4-methylpiperazin-1-yl)phenyl]-3H-imidazo[4,5-b]pyridin-7-yl}-4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCT137690 [DBID]
CCT-137690 [DBID]
CCRIS 4693 [DBID]
CCT 137690 [DBID]
PubChem Substance ID 329825761 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Target Organs:

      Aurora Kinase inhibitor TargetMol T2611

    • Bio Activity:

      Aurora A/B/C TargetMol T2611
      Aurora Kinase MedChem Express HY-10804
      Aurora Kinases Tocris Bioscience 4291
      CCT 137690 is a potent inhibitor of Aurora kinases (IC50 values are 0.015, 0.019 and 0.025 ?M at Aurora A, Aurora C and Aurora B respectively). MedChem Express HY-10804
      Cell Cycle/Checkpoint TargetMol T2611
      Cell Cycle/DNA Damage MedChem Express HY-10804
      Cell Cycle/DNA Damage; MedChem Express HY-10804
      Enzymes Tocris Bioscience 4291
      Kinases Tocris Bioscience 4291
      Potent inhibitor of Aurora kinases (IC50 values are 0.015, 0.019 and 0.025 ?M at Aurora A, Aurora C and Aurora B respectively). Displays antiproliferative activity in a range of human tumor cell lines . Orally bioavailable. Tocris Bioscience 4291
      Potent inhibitor of Aurora kinases (IC50 values are 0.015, 0.019 and 0.025 ?M at Aurora A, Aurora C and Aurora B respectively). Displays antiproliferative activity in a range of human tumor cell lines. Orally bioavailable. Tocris Bioscience 4291
      Potent inhibitor of Aurora kinases (IC50 values are 0.015, 0.019 and 0.025 muM at Aurora A, Aurora C and Aurora B respectively). Displays antiproliferative activity in a range of human tumor cell lines. Orally bioavailable. Tocris Bioscience 4291
      Potent pan-Aurora kinase inhibitor Tocris Bioscience 4291

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

Density: 1.4±0.1 g/cm3
Boiling Point: 722.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 391.0±35.7 °C
Index of Refraction: 1.664
Molar Refractivity: 143.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.07
ACD/LogD (pH 5.5): -1.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.15
ACD/BCF (pH 7.4): 1.82
ACD/KOC (pH 7.4): 18.61
Polar Surface Area: 81 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 63.4±3.0 dyne/cm
Molar Volume: 387.0±3.0 cm3

Click to predict properties on the Chemicalize site


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