ChemSpider 2D Image | 1-(2,4-Dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(1-piperidinyl)-1H-pyrazole-3-carboxamide | C22H21Cl2IN4O

1-(2,4-Dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(1-piperidinyl)-1H-pyrazole-3-carboxamide

  • Molecular FormulaC22H21Cl2IN4O
  • Average mass555.239 Da
  • Monoisotopic mass554.013672 Da
  • ChemSpider ID2040

More details:






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

1-(2,4-Dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(1-piperidinyl)-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
1-(2,4-Dichlorophényl)-5-(4-iodophényl)-4-méthyl-N-(1-pipéridinyl)-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
1-(2,4-Dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(piperidin-1-yl)-1H-pyrazole-3-carboxamide
1-(2,4-Dichlorphenyl)-5-(4-iodphenyl)-4-methyl-N-(1-piperidinyl)-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxamide, 1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-1-piperidinyl- [ACD/Index Name]
[183232-66-8]
1-(2,4-Dichloro-phenyl)-5-(4-iodo-phenyl)-4-methyl-1H-pyrazole-3-carboxylic acid piperidin-1-ylamide
1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(1-piperidyl)-3-pyrazolecarboxamide
1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(1-piperidyl)pyrazole-3-carboxamide
1-(2,4-Dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-1-piperidinyl-1H-pyrazole-3-carboxamide
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

A6226_SIGMA [DBID]
Bio1_000119 [DBID]
Bio1_000608 [DBID]
Bio1_001097 [DBID]
Bio2_000245 [DBID]
Bio2_000725 [DBID]
CBiol_001833 [DBID]
KBio2_000245 [DBID]
KBio2_002813 [DBID]
KBio2_005381 [DBID]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      5 Axon Medchem 1218
      H303;H313;H317;H333;H334;H335;H373 Axon Medchem 1218
      no pictogram Axon Medchem 1218
      P101;P102;P103;P260;P262;P263;P264;P270;P280;P304;P312;P340 Axon Medchem 1218
      Warning Axon Medchem 1218
    • Target Organs:

      Cannabinoid Receptor antagonist TargetMol T1915
    • Bio Activity:

      AM251 is a potent CB1 receptor antagonist (IC50 = 8 nM, Ki = 7.49 nM) that displays 306-fold selectivity over CB2 receptors; also potent GPR55 agonist (EC50 = 39 nM). MedChem Express
      AM251 is a potent CB1 receptor antagonist (IC50 = 8 nM, Ki = 7.49 nM) that displays 306-fold selectivity over CB2 receptors; also potent GPR55 agonist (EC50 = 39 nM).; IC50 value: ; Target: CB1 receptor antagonist; in vitro: In in vitro binding assays with mouse hippocampal membranes, tetrahydrocannabinol inhibited binding of [123I]AM251 with an IC50 value of about 700 nM, compared with about 0.2 nM for SR141716A [1]. MedChem Express HY-15443
      Cannabinoid Receptor MedChem Express HY-15443
      CB1 TargetMol T1915
      GPCR/G protein MedChem Express HY-15443
      GPCR/G Protein TargetMol T1915
      Potent CB1 antagonist; also GPR55 agonist Tocris Bioscience 1117
      Potent CB1 receptor antagonist (IC50 = 8 nM, Ki = 7.49 nM) that displays 306-fold selectivity over CB2 receptors. Also potent GPR55 agonist (EC50 = 39 nM). Also available in a fluorescent form (Cat. N o. 2540). Tocris Bioscience 1117

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.703
Molar Refractivity: 130.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 6.45
ACD/LogD (pH 5.5): 5.84
ACD/BCF (pH 5.5): 16061.91
ACD/KOC (pH 5.5): 35600.25
ACD/LogD (pH 7.4): 5.84
ACD/BCF (pH 7.4): 16142.85
ACD/KOC (pH 7.4): 35779.65
Polar Surface Area: 50 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 336.1±7.0 cm3

Click to predict properties on the Chemicalize site





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