Found 1 result

Search term: UBJOTBARWOGPMC-MHZLTWQESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (1R)-N~2~-[5-Chloro-2-(5-chloro-2-pyridinyl)-6-methyl-4-pyrimidinyl]-1-phenyl-N~1~-(6-phenylhexyl)-1,2-ethanediamine | C30H33Cl2N5

(1R)-N2-[5-Chloro-2-(5-chloro-2-pyridinyl)-6-methyl-4-pyrimidinyl]-1-phenyl-N1-(6-phenylhexyl)-1,2-ethanediamine

  • Molecular FormulaC30H33Cl2N5
  • Average mass534.523 Da
  • Monoisotopic mass533.211304 Da
  • ChemSpider ID30828971

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-N2-[5-Chlor-2-(5-chlor-2-pyridinyl)-6-methyl-4-pyrimidinyl]-1-phenyl-N1-(6-phenylhexyl)-1,2-ethandiamin [German] [ACD/IUPAC Name]
(1R)-N2-[5-Chloro-2-(5-chloro-2-pyridinyl)-6-methyl-4-pyrimidinyl]-1-phenyl-N1-(6-phenylhexyl)-1,2-ethanediamine [ACD/IUPAC Name]
(1R)-N2-[5-Chloro-2-(5-chloro-2-pyridinyl)-6-méthyl-4-pyrimidinyl]-1-phényl-N1-(6-phénylhexyl)-1,2-éthanediamine [French] [ACD/IUPAC Name]
1,2-Ethanediamine, N2-[5-chloro-2-(5-chloro-2-pyridinyl)-6-methyl-4-pyrimidinyl]-1-phenyl-N1-(6-phenylhexyl)-, (1R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 632.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.3±31.5 °C
Index of Refraction: 1.618
Molar Refractivity: 154.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 7.93
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 278.07
ACD/KOC (pH 5.5): 317.62
ACD/LogD (pH 7.4): 5.99
ACD/BCF (pH 7.4): 10987.44
ACD/KOC (pH 7.4): 12550.00
Polar Surface Area: 63 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 440.5±3.0 cm3

Click to predict properties on the Chemicalize site


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