ChemSpider 2D Image | SGI-1027 | C27H23N7O

SGI-1027

  • Molecular FormulaC27H23N7O
  • Average mass461.518 Da
  • Monoisotopic mass461.196411 Da
  • ChemSpider ID29419324

More details:

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

1020149-73-8 [RN]
Benzamide, N-[4-[(2-amino-6-methyl-4-pyrimidinyl)amino]phenyl]-4-(4-quinolinylamino)- [ACD/Index Name]
MFCD27937047
N-(4-(2-Amino-6-methylpyrimidin-4-ylamino)phenyl)-4-(quinolin-4-ylamino) benzamide
N-{4-[(2-Amino-6-methyl-4-pyrimidinyl)amino]phenyl}-4-(4-chinolinylamino)benzamid [German] [ACD/IUPAC Name]
N-{4-[(2-Amino-6-méthyl-4-pyrimidinyl)amino]phényl}-4-(4-quinoléinylamino)benzamide [French] [ACD/IUPAC Name]
N-{4-[(2-Amino-6-methyl-4-pyrimidinyl)amino]phenyl}-4-(4-quinolinylamino)benzamide [ACD/IUPAC Name]
N-{4-[(2-AMINO-6-METHYLPYRIMIDIN-4-YL)AMINO]PHENYL}-4-(QUINOLIN-4-YLAMINO)BENZAMIDE
N-{4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl}-4-[(quinolin-4-yl)amino]benzamide
SGI-1027
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    • Target Organs:

      DNA Methyltransferase inhibitor TargetMol T1904

    • Bio Activity:

      Cell Cycle/DNA Damage MedChem Express HY-13962
      Cell Cycle/DNA Damage; MedChem Express HY-13962
      Chromatin/Epigenetic TargetMol T1904
      DNA methyltransferase inhibitor Tocris Bioscience 5155
      DNA methyltransferase inhibitor. Inhibits the mammalian DNA methyltransferases DNMT3B, DNMT3A and DNMT1 (IC50 values are 7.5, 8 and 12.5 ?M with Poly(dl-dC) as the substrate). Reactivates silenced tum or suppressor genes by reducing CpG island hypermethylation. Tocris Bioscience 5155
      DNA methyltransferase inhibitor. Inhibits the mammalian DNA methyltransferases DNMT3B, DNMT3A and DNMT1 (IC50 values are 7.5, 8 and 12.5 ?M with Poly(dl-dC) as the substrate). Reactivates silenced tumor suppressor genes by reducing CpG island hypermethylation. Tocris Bioscience 5155
      DNA methyltransferase inhibitor. Inhibits the mammalian DNA methyltransferases DNMT3B, DNMT3A and DNMT1 (IC50 values are 7.5, 8 and 12.5 muM with Poly(dl-dC) as the substrate). Reactivates silenced tumor suppressor genes by reducing CpG island hypermethylation. Tocris Bioscience 5155
      DNA Methyltransferases Tocris Bioscience 5155
      DNMT MedChem Express HY-13962
      DNMT1/3A/3B TargetMol T1904
      Enzymes Tocris Bioscience 5155
      SGI-1027 is a potent and selective inhibitor of DNA methyltransferase (DNMT) with IC50 of 6, 8, 7.5 ?M for DNMT1, DNMT3A, and DNMT3B, respectively.; IC50 value: 6/8/7.5 uM (DNMT1/3A/3B) [1]; Target: DNMT1/3A/3B; SGI-1027, inhibits the activity of DNMT1, DNMT3A, and DNMT3B as well M. MedChem Express HY-13962
      Transferases Tocris Bioscience 5155

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.789
Molar Refractivity: 140.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 2.35
ACD/KOC (pH 5.5): 11.90
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 503.57
ACD/KOC (pH 7.4): 2551.83
Polar Surface Area: 118 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 76.3±3.0 dyne/cm
Molar Volume: 332.7±3.0 cm3

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