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Home Page Flashcards Citalopram hydrobromide C20H22BrFN2O structure - Flashcards

Citalopram hydrobromide C20H22BrFN2O structure – Flashcards

Flashcard maker : Lisa Currey

Molecular Formula C20H22BrFN2O
Average mass 405.304 Da
Density
Boiling Point
Flash Point
Molar Refractivity
Polarizability
Surface Tension
Molar Volume
  • Experimental data
  • Predicted – ACD/Labs
  • Predicted – ChemAxon
  • Predicted – Mcule
  • Experimental Physico-chemical Properties

    • Experimental Melting Point:

      185-187 °C Oxford University Chemical Safety Data (No longer updated) More details
      182 °C LKT Labs
      [C3477]
      186 °C Biosynth Q-200866
      177-179 °C LabNetwork LN00188799

    • Experimental Flash Point:

      213 °C Biosynth Q-200866

    • Experimental Solubility:

      DMSO:38mg/mL MedChem Express http://www.medchemexpress.com/Citric-acid-trilithium-salt-tetrahydrate.html, HY-B1287
      Soluble in DMSO Axon Medchem 1320
      Soluble in ethanol or chloroform. Sparingly soluble in water. LKT Labs
      [C3477]
      Soluble to 50 mM in ethanol and to 10 mM in water Tocris Bioscience 1427
  • Miscellaneous

    • Appearance:

      solid Oxford University Chemical Safety Data (No longer updated) More details

    • Stability:

      Stable. Incompatible with strong oxidizing agents. Oxford University Chemical Safety Data (No longer updated) More details

    • Safety:

      5 Axon Medchem 1320
      GHS07 Biosynth Q-200866, W-105304
      H302 Biosynth Q-200866, W-105304
      H302 LKT Labs
      [C3477]
      H303;H313;H317;H333;H334;H335;H373 Axon Medchem 1320
      IRRITANT Matrix Scientific 090185
      Minimize exposure. Oxford University Chemical Safety Data (No longer updated) More details
      no pictogram Axon Medchem 1320
      None LKT Labs
      [C3477]
      P101;P102;P103;P260;P262;P263;P264;P270;P280;P304;P312;P340 Axon Medchem 1320
      P261; P280; P302+P352; P304+P340; P305+P351+P338; P312 Biosynth Q-200866
      Warning Biosynth Q-200866, W-105304
      Warning Axon Medchem 1320
      Xn Abblis Chemicals AB1010898

    • Target Organs:

      Serotonin uptake inhibitor;AChR antagonist;Adrenergic Receptor antagonist;Histamine Receptor TargetMol T1483

    • Drug Status:

      approved BIONET-Key Organics KS-1043

    • Bio Activity:

      5-HT Receptor MedChem Express HY-B1287
      5-HT Transporters Tocris Bioscience 1427
      Citalopram hydrobromide is an antidepressant drug of the selective serotonin reuptake inhibitor (SSRI) class. MedChem Express http://www.medchemexpress.com/Citric-acid-trilithium-salt-tetrahydrate.html
      Citalopram hydrobromide is an antidepressant drug of the selective serotonin reuptake inhibitor (SSRI) class. It has US FDA approval to treat major depression. MedChem Express HY-B1287
      GPCR/G protein; Neuronal Signaling; MedChem Express HY-B1287
      Highly potent and selective 5-HT uptake inhibitor Tocris Bioscience 1427
      Highly selective and potent 5-HT uptake inhibitor with no effect on noradrenalin or dopamine uptake (IC50 values are 1.8, 8800 and 41000 nM respectively). Has negligible activity at a wide range of re
      ceptors. Also available as part of the Serotonin Uptake Inhibitor Tocriset™. Tocris Bioscience 1427
      Highly selective and potent 5-HT uptake inhibitor with no effect on noradrenalin or dopamine uptake (IC50 values are 1.8, 8800 and 41000 nM respectively). Has negligible activity at a wide range of receptors. Tocris Bioscience 1427
      Neuroscience TargetMol T1483
      Neurotransmitter Transporters Tocris Bioscience 1427
      Sodium-dependent serotonin transporter;Muscarinic AChR;??-adrenergic receptor;Histamine H1 receptor TargetMol T1483
      Transporters Tocris Bioscience 1427

Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module

No predicted properties have been calculated for this compound.

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site

  • 1-Click Docking
  • 1-Click Scaffold Hop

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