ChemSpider 2D Image | (4R)-2-Amino-1,3',3'-trimethyl-7'-(5-pyrimidinyl)-3',4'-dihydro-2'H-spiro[imidazole-4,1'-naphthalen]-5(1H)-one | C19H21N5O

(4R)-2-Amino-1,3',3'-trimethyl-7'-(5-pyrimidinyl)-3',4'-dihydro-2'H-spiro[imidazole-4,1'-naphthalen]-5(1H)-one

  • Molecular FormulaC19H21N5O
  • Average mass335.403 Da
  • Monoisotopic mass335.174622 Da
  • ChemSpider ID29405329

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4R)-2-Amino-1,3',3'-trimethyl-7'-(5-pyrimidinyl)-3',4'-dihydro-2'H-spiro[imidazole-4,1'-naphthalen]-5(1H)-on [German] [ACD/IUPAC Name]
(4R)-2-Amino-1,3',3'-trimethyl-7'-(5-pyrimidinyl)-3',4'-dihydro-2'H-spiro[imidazole-4,1'-naphthalen]-5(1H)-one [ACD/IUPAC Name]
(4R)-2-Amino-1,3',3'-triméthyl-7'-(5-pyrimidinyl)-3',4'-dihydro-2'H-spiro[imidazole-4,1'-naphthalen]-5(1H)-one [French] [ACD/IUPAC Name]
(4r)-2-Amino-1,3',3'-Trimethyl-7'-(Pyrimidin-5-Yl)-3',4'-Dihydro-2'h-Spiro[imidazole-4,1'-Naphthalen]-5(1h)-One
Spiro[4H-imidazole-4,1'(2'H)-naphthalen]-5(1H)-one, 2-amino-3',4'-dihydro-1,3',3'-trimethyl-7'-(5-pyrimidinyl)-, (4R)- [ACD/Index Name]
1338092-74-2 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 525.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.7±32.9 °C
Index of Refraction: 1.692
Molar Refractivity: 96.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): 0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.49
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 11.56
ACD/KOC (pH 7.4): 191.32
Polar Surface Area: 84 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 54.2±7.0 dyne/cm
Molar Volume: 251.5±7.0 cm3

Click to predict properties on the Chemicalize site


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