ChemSpider 2D Image | AA 29504 | C19H25N3O2

AA 29504

  • Molecular FormulaC19H25N3O2
  • Average mass327.421 Da
  • Monoisotopic mass327.194672 Da
  • ChemSpider ID16236062

More details:

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

{2-Amino-4-[(mésitylméthyl)amino]phényl}carbamate d'éthyle [French] [ACD/IUPAC Name]
945828-50-2 [RN]
AA 29504
Carbamic acid, N-[2-amino-4-[[(2,4,6-trimethylphenyl)methyl]amino]phenyl]-, ethyl ester [ACD/Index Name]
Ethyl {2-amino-4-[(mesitylmethyl)amino]phenyl}carbamate [ACD/IUPAC Name]
Ethyl-{2-amino-4-[(mesitylmethyl)amino]phenyl}carbamat [German] [ACD/IUPAC Name]
MFCD19690927
N-[2-Amino-4-[[(2,4,6-trimethylphenyl)methyl]amino]phenyl]-carbamic acid-ethyl ester
[945828-50-2] [RN]
N1-Ethoxycarbonyl-N4-[(2,4,6-trimethylpheny)lmethyl]-1,2,4-triaminobenzene
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

UN2811 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      GABAA and A-rho Receptors Tocris Bioscience 3972
      Ion Channels Tocris Bioscience 3972
      Ligand-gated Ion Channels Tocris Bioscience 3972
      Positive allosteric modulator of GABAA receptors Tocris Bioscience 3972
      Positive allosteric modulator of GABAA receptors. Modulates both ?4?3?-containing extrasynaptic receptors and ?1?3?2S-containing receptors in Xenopus oocytes, displaying a stronger modulatory effect a t the former. Reduces motor coordination and exhibits anxiolytic effects in vivo. Tocris Bioscience 3972
      Positive allosteric modulator of GABAA receptors. Modulates both ?4?3?-containing extrasynaptic receptors and ?1?3?2S-containing receptors in Xenopus oocytes, displaying a stronger modulatory effect at the former. Reduces motor coordination and exhibits anxiolytic effects in vivo. Tocris Bioscience 3972
      Positive allosteric modulator of GABAA receptors. Modulates both alpha4beta3delta-containing extrasynaptic receptors and alpha1beta3gamma2S-containing receptors in Xenopus oocytes, displaying a stronger modulatory effect at the former. Reduces motor coordination and exhibits anxiolytic effects in vivo. Tocris Bioscience 3972

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

Density: 1.2±0.1 g/cm3
Boiling Point: 469.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 237.8±28.7 °C
Index of Refraction: 1.640
Molar Refractivity: 99.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 155.79
ACD/KOC (pH 5.5): 1041.66
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 327.10
ACD/KOC (pH 7.4): 2187.08
Polar Surface Area: 76 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 276.6±3.0 cm3

Click to predict properties on the Chemicalize site


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