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Search term: PPANZCQXFYBGHN-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | PF-4840154 | C26H38N6O2

PF-4840154

  • Molecular FormulaC26H38N6O2
  • Average mass466.619 Da
  • Monoisotopic mass466.305634 Da
  • ChemSpider ID26610754

More details:

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

1332708-14-1 [RN]
N-benzyl-4-[(2-methylpropyl)amino]-2-[4-(oxan-3-ylmethyl)piperazin-1-yl]pyrimidine-5-carboxamide
N-benzyl-4-[(2-methylpropyl)amino]-2-{4-[(oxan-3-yl)methyl]piperazin-1-yl}pyrimidine-5-carboxamide
PF-4840154 [Wiki]
4-?[(2-?methylpropyl)?amino]?-?N-?(phenylmethyl)?-?2-?[4-?[(tetrahydro-?2H-?pyran-?3-?yl)?methyl]?-?1-?piperazinyl]?-5-?Pyrimidinecarboxamid?e
4-[(2-methylpropyl)amino]-N-(phenylmethyl)-2-[4-[(tetrahydro-2H-pyran-3-yl)methyl]-1-piperazinyl]-5-pyrimidinecarboxamide
5-Pyrimidinecarboxamide, 4-[(2-methylpropyl)amino]-N-(phenylmethyl)-2-[4-[(tetrahydro-2H-pyran-3-yl)methyl]-1-piperazinyl]- [ACD/Index Name]
MFCD28385599
N-benzyl-4-(2-methylpropylamino)-2-[4-(oxan-3-ylmethyl)piperazin-1-yl] pyrimidine-5-carboxamide
N-Benzyl-4-(isobutylamino)-2-[4-(tetrahydro-2H-pyran-3-ylmethyl)-1-piperazinyl]-5-pyrimidincarboxamid [German] [ACD/IUPAC Name]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      Membrane Tranporter/Ion Channel MedChem Express HY-18779
      Membrane Tranporter/Ion Channel; MedChem Express HY-18779
      PF-4840154 is a potent, selective agonist of the rat and human TrpA1 channel and elicited TrpA1-mediated nocifensive behaviour in mouse, with EC50 of 97 nM and 23 nM for rTrpA1 and hTrpA1, respectivel y. MedChem Express
      PF-4840154 is a potent, selective agonist of the rat and human TrpA1 channel and elicited TrpA1-mediated nocifensive behaviour in mouse, with EC50 of 97 nM and 23 nM for rTrpA1 and hTrpA1, respectively.; IC50 value: 97 nM (EC50, for rTrpA1), 23 nM (EC50, for hTrpA1); Target: TrpA1; PF-4840154 is a non-electrophilic reference agonist of the TrpA1 channel. MedChem Express HY-18779
      PF-4840154 is a potent, selective agonist of the rat and human TrpA1 channel and elicited TrpA1-mediated nocifensive behaviour in mouse, with EC50 of 97 nM and 23 nM for rTrpA1 and hTrpA1, respectively.;IC50 value: 97 nM (EC50, for rTrpA1), 23 nM (EC50, for hTrpA1);Target: TrpA1PF-4840154 is a non-electrophilic reference agonist of the TrpA1 channel. PF-4840154 is initiated to establish its suitability as a reference agonist of the TrpA1 channel. MedChem Express HY-18779
      TRP Channel MedChem Express HY-18779

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.589
Molar Refractivity: 135.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.03
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 21.27
ACD/KOC (pH 5.5): 82.57
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1218.33
ACD/KOC (pH 7.4): 4728.90
Polar Surface Area: 83 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 52.3±3.0 dyne/cm
Molar Volume: 400.7±3.0 cm3

Click to predict properties on the Chemicalize site


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