ChemSpider 2D Image | Tedisamil | C19H32N2

Tedisamil

  • Molecular FormulaC19H32N2
  • Average mass288.471 Da
  • Monoisotopic mass288.256561 Da
  • ChemSpider ID28528215

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

3,7-Bis(cyclopropylmethyl)-3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane] [ACD/IUPAC Name]
90961-53-8 [RN]
Tedisamil [INN] [USAN] [Wiki]
3,7-bis(cyclopropylmethyl)spiro[3,7-diazabicyclo[3.3.1]nonane-9,1'-cyclopentane]
KC-8857
Pulzium
Spiro[cyclopentane-1,9'-[3,7]diazabicyclo[3.3.1]nonane], 3',7'-bis(cyclopropylmethyl)- [ACD/Index Name]
tedisamil; tedisamilum

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

KC 8857 [DBID]
KC8857 [DBID]
  • Miscellaneous

    • Chemical Class:

      A member of the class of diazabicyclononanes that is (1s,5s)-3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane] in which the hydrogens at positions 3 and 7 are replaced by cyclopropylmethyl groups . It is a potassium channel blocker and an antiarrhythmic agent currently currently in development for the treatment of atrial fibrillation. ChEBI CHEBI:134747

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

Density: 1.1±0.1 g/cm3
Boiling Point: 372.5±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.0±3.0 kJ/mol
Flash Point: 162.6±6.8 °C
Index of Refraction: 1.580
Molar Refractivity: 87.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.15
ACD/LogD (pH 5.5): 0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 11.87
ACD/KOC (pH 7.4): 60.92
Polar Surface Area: 6 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 263.1±5.0 cm3

Click to predict properties on the Chemicalize site


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