Found 1 result

Search term: VUVUVNZRUGEAHB-CYBMUJFWSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | I-BET151 | C23H21N5O3

I-BET151

  • Molecular FormulaC23H21N5O3
  • Average mass415.444 Da
  • Monoisotopic mass415.164429 Da
  • ChemSpider ID26325341

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1300031-49-5 [RN]
2H-Imidazo[4,5-c]quinolin-2-one, 7-(3,5-dimethyl-4-isoxazolyl)-1,3-dihydro-8-methoxy-1-[(1R)-1-(2-pyridinyl)ethyl]- [ACD/Index Name]
7-(3,5-Dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-[(1R)-1-(2-pyridinyl)ethyl]-1,3-dihydro-2H-imidazo[4,5-c]chinolin-2-on [German] [ACD/IUPAC Name]
7-(3,5-Diméthyl-1,2-oxazol-4-yl)-8-méthoxy-1-[(1R)-1-(2-pyridinyl)éthyl]-1,3-dihydro-2H-imidazo[4,5-c]quinoléin-2-one [French] [ACD/IUPAC Name]
7-(3,5-Dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-[(1R)-1-(2-pyridinyl)ethyl]-1,3-dihydro-2H-imidazo[4,5-c]quinolin-2-one [ACD/IUPAC Name]
7-(3,5-Dimethyl-1,2-Oxazol-4-Yl)-8-Methoxy-1-[(1r)-1-(Pyridin-2-Yl)ethyl]-1h,2h,3h-Imidazo[4,5-C]quinolin-2-One
7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methoxy-1-[(1R)-1-(pyridin-2-yl)ethyl]-3H-imidazo[4,5-c]quinolin-2-one
7-(3,5-Dimethyl-4-isoxazolyl)-1,3-dihydro-8-methoxy-1-[(1R)-1-(2-pyridinyl)ethyl]-2H-imidazo[4,5-c]quinolin-2-one
I-BET151
[1300031-49-5] [RN]
More...

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

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      BET bromodomain MedChem Express HY-13235
      Cell Cycle/DNA Damage MedChem Express HY-13235
      Cell Cycle/DNA Damage; MedChem Express HY-13235
      I-BET151(GSK1210151A) is a BET bromodomain inhibitor(pIC50=6.1,BRD4); I-BET151 blocks recruitment of BET to chromatin . MedChem Express http://www.medchemexpress.com/luf6000.html, HY-13235
      I-BET151(GSK1210151A) is a BET bromodomain inhibitor(pIC50=6.1,BRD4); I-BET151 blocks recruitment of BET to chromatin . ;IC50 value: 6.1(pIC50) [1];Target: BET bromodomain;I-BET151 induces apoptosis and G0/G1 cell cycle arrest in MLL-fusion leukemic cell lines in vitro (IC50 values are 15, 26, 120 and 192 nM for NOMO1, MV4;11, MOLM13 and RS4;11 cell lines respectively). I-BET151 reduces BCL2 expression in NOMO1 cells. I-BET151 improves survival in two rodents models of MLL-fusion leukemia in vivo. MedChem Express HY-13235

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: 1.651
Molar Refractivity: 115.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 29.68
ACD/KOC (pH 5.5): 314.27
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 64.86
ACD/KOC (pH 7.4): 686.86
Polar Surface Area: 93 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 316.1±3.0 cm3

Click to predict properties on the Chemicalize site


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