ChemSpider 2D Image | 2HR315841W | C9H7ClFN5O2

2HR315841W

  • Molecular FormulaC9H7ClFN5O2
  • Average mass271.636 Da
  • Monoisotopic mass271.027222 Da
  • ChemSpider ID24642636

More details:

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

1,2,5-Oxadiazole-3-carboximidamide, 4-amino-N'-(3-chloro-4-fluorophenyl)-N-hydroxy- [ACD/Index Name]
2HR315841W
4-Amino-N-(3-chlor-4-fluorphenyl)-N'-hydroxy-1,2,5-oxadiazol-3-carboximidamid [German] [ACD/IUPAC Name]
4-Amino-N-(3-chloro-4-fluorophenyl)-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide [ACD/IUPAC Name]
4-Amino-N-(3-chloro-4-fluorophényl)-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide [French] [ACD/IUPAC Name]
914471-09-3 [RN]
INCB024360 analog
indoleamine-2,3-dioxygenase inhibitor incb024360
(E)-4-amino-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide
(Z)-4-amino-N-(3-chloro-4-fluorophenyl)-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide
More...

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

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

    • Bio Activity:

      Enzymes Tocris Bioscience 6007
      IDO Tocris Bioscience 6007
      IDO MedChem Express HY-15683
      IDO-IN-2 is a potent IDO1 inhibitor with IC50 of 67 nM, has an IC50 of 19 nM in Hela cell. MedChem Express http://www.medchemexpress.com/tulathromycin-a.html, HY-15683
      IDO-IN-2 is a potent IDO1 inhibitor with IC50 of 67 nM, has an IC50 of 19 nM in Hela cell.;IC50 value: 67 nM [3];Target: IDO MedChem Express HY-15683
      Metabolic Enzyme/Protease; MedChem Express HY-15683
      Others MedChem Express HY-15683
      Oxygenases/Oxidases Tocris Bioscience 6007
      Potent indoleamine 2,3-dioxygenase (IDO) inhibitor Tocris Bioscience 6007
      Potent indoleamine 2,3-dioxygenase (IDO) inhibitor (IC50 values are 19 and 67 nM in enzymatic activity and HeLa cell assays, respectively). Decreases kynurenine levels in plasma and reduces tumor growth in vivo. Cell membrane permeable. Tocris Bioscience 6007

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

Density: 1.8±0.1 g/cm3
Boiling Point: 504.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.5±3.0 kJ/mol
Flash Point: 259.0±32.9 °C
Index of Refraction: 1.715
Molar Refractivity: 59.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.49
ACD/KOC (pH 5.5): 291.29
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 15.04
ACD/KOC (pH 7.4): 224.86
Polar Surface Area: 110 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 65.2±7.0 dyne/cm
Molar Volume: 152.2±7.0 cm3

Click to predict properties on the Chemicalize site


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