ChemSpider 2D Image | 7-CHLORO-3-{[4-HYDROXY-1-(3-PHENYLPROPANOYL)PIPERIDIN-4-YL]METHYL}QUINAZOLIN-4-ONE | C23H24ClN3O3

7-CHLORO-3-{[4-HYDROXY-1-(3-PHENYLPROPANOYL)PIPERIDIN-4-YL]METHYL}QUINAZOLIN-4-ONE

  • Molecular FormulaC23H24ClN3O3
  • Average mass425.908 Da
  • Monoisotopic mass425.150604 Da
  • ChemSpider ID29875500

More details:

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

1381291-36-6 [RN]
4(3H)-Quinazolinone, 7-chloro-3-[[4-hydroxy-1-(1-oxo-3-phenylpropyl)-4-piperidinyl]methyl]- [ACD/Index Name]
7-Chlor-3-{[4-hydroxy-1-(3-phenylpropanoyl)-4-piperidinyl]methyl}-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
7-Chloro-3-{[4-hydroxy-1-(3-phenylpropanoyl)-4-piperidinyl]methyl}-4(3H)-quinazolinone [ACD/IUPAC Name]
7-Chloro-3-{[4-hydroxy-1-(3-phénylpropanoyl)-4-pipéridinyl]méthyl}-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
7-chloro-3-{[4-hydroxy-1-(3-phenylpropanoyl)piperidin-4-yl]methyl}-3,4-dihydroquinazolin-4-one
7-CHLORO-3-{[4-HYDROXY-1-(3-PHENYLPROPANOYL)PIPERIDIN-4-YL]METHYL}QUINAZOLIN-4-ONE
7-?chloro-?3-?[[4-?hydroxy-?1-?(1-?oxo-?3-?phenylpropyl)?-?4-?piperidinyl]?methyl]?-4(3H)?-?Quinazolinone
7-Chloro-3-((4-hydroxy-1-(3-phenylpropanoyl)piperidin-4-yl)methyl)quinazolin-4(3H)-one
7-chloro-3-[[4-hydroxy-1-(3-phenylpropanoyl)piperidin-4-yl]methyl]quinazolin-4-one
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      Cell Cycle/DNA Damage MedChem Express HY-16709
      Cell Cycle/DNA Damage; MedChem Express HY-16709
      Deubiquitinase MedChem Express HY-16709
      USP7-IN-1 is a novel selective and reversible inhibitor of USP7 with IC50 of 33 uM; less or no inhibition on USP5, USP8, Uch-L1, Uch-L3 and Caspase(IC50 MedChem Express http://www.medchemexpress.com/pifithrin-_beta_-hydrobromide.html
      USP7-IN-1 is a novel selective and reversible inhibitor of USP7 with IC50 of 33 uM; less or no inhibition on USP5, USP8, Uch-L1, Uch-L3 and Caspase(IC50>200 uM); HCT116 cell viability GI50 is 67 uM.; IC50 value: 33 uM; Target: USP7 selective inhibitor; Preparation of quinazoline derivatives useful as selective and reversible inhibitors of USP7; By Colland, Frederic; Gourdel, Marie-Edith ; From PCT Int. MedChem Express HY-16709
      USP7-IN-1 is a novel selective and reversible inhibitor of USP7 with IC50 of 33 uM; less or no inhibition on USP5, USP8, Uch-L1, Uch-L3 and Caspase(IC50>200 uM); HCT116 cell viability GI50 is 67 uM.;IC50 value: 33 uM;Target: USP7 selective inhibitorPreparation of quinazoline derivatives useful as selective and reversible inhibitors of USP7By Colland, Frederic; Gourdel, Marie-Edith From PCT Int. Appl. (2013), WO 2013030218 A1 20130307. MedChem Express HY-16709

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

Density: 1.3±0.1 g/cm3
Boiling Point: 666.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.9±3.0 kJ/mol
Flash Point: 356.7±34.3 °C
Index of Refraction: 1.649
Molar Refractivity: 117.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 3.21
ACD/BCF (pH 5.5): 162.46
ACD/KOC (pH 5.5): 1330.60
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 162.46
ACD/KOC (pH 7.4): 1330.63
Polar Surface Area: 73 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 54.2±7.0 dyne/cm
Molar Volume: 321.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement