ChemSpider 2D Image | TMCB | C11H9Br4N3O2

TMCB

  • Molecular FormulaC11H9Br4N3O2
  • Average mass534.824 Da
  • Monoisotopic mass530.742798 Da
  • ChemSpider ID25058162

More details:

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

[4,5,6,7-Tetrabrom-2-(dimethylamino)-1H-benzimidazol-1-yl]essigsäure [German] [ACD/IUPAC Name]
[4,5,6,7-Tetrabromo-2-(dimethylamino)-1H-benzimidazol-1-yl]acetic acid [ACD/IUPAC Name]
1085822-09-8 [RN]
1H-Benzimidazole-1-acetic acid, 4,5,6,7-tetrabromo-2-(dimethylamino)- [ACD/Index Name]
905105-89-7 [RN]
Acide [4,5,6,7-tétrabromo-2-(diméthylamino)-1H-benzimidazol-1-yl]acétique [French] [ACD/IUPAC Name]
compound 2c [PMID: 22115617]
TMCB
[4,5,6,7-TETRABROMO-2-(DIMETHYLAMINO)-1,3-BENZODIAZOL-1-YL]ACETIC ACID
[905105-89-7] [RN]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      Casein Kinase 2 Tocris Bioscience 3675
      Dual-kinase inhibitor; inhibits both casein kinase 2 (CK2) and extracellular-signal-regulated kinase 8 (ERK8) (IC50 = 0.50 ?M for both CK2 and ERK8). Displays selectivity for CK2 over protein kinases normally susceptible to CK2 inhibitors (Ki values are 0.25, 8.65, 11.90 and 15.25 ?M for CK2, PIM1, DYRK1a and HIPK2 respectively). Tocris Bioscience 3675
      Dual-kinase inhibitor; inhibits both casein kinase 2 (CK2) and extracellular-signal-regulated kinase 8 (ERK8) (IC50 = 0.50 ?M for both CK2 and ERK8). Displays selectivity for CK2 over protein kinases normally susceptible to CK2 inhibitors (Ki values are 0.25, 8.65, 11.90 and 15.25 ?M for CK2, PIM1, DYRK1a and HIPK2 respectively). Tocris Bioscience 3675
      Dual-kinase inhibitor; inhibits both casein kinase 2 (CK2) and extracellular-signal-regulated kinase 8 (ERK8) (IC50 = 0.50 muM for both CK2 and ERK8). Displays selectivity for CK2 over protein kinases normally susceptible to CK2 inhibitors (Ki values are 0.25, 8.65, 11.90 and 15.25 muM for CK2, PIM1, DYRK1a and HIPK2 respectively). Tocris Bioscience 3675
      Dual-kinase inhibitor; inhibits CK2 and ERK8 Tocris Bioscience 3675
      Enzymes Tocris Bioscience 3675
      Kinases Tocris Bioscience 3675

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

Density: 2.4±0.1 g/cm3
Boiling Point: 588.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 309.9±32.9 °C
Index of Refraction: 1.752
Molar Refractivity: 90.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 4.46
ACD/LogD (pH 5.5): 2.66
ACD/BCF (pH 5.5): 22.09
ACD/KOC (pH 5.5): 93.73
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.43
Polar Surface Area: 58 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 63.9±7.0 dyne/cm
Molar Volume: 222.1±7.0 cm3

Click to predict properties on the Chemicalize site


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