ChemSpider 2D Image | (7R)-8-Cyclopentyl-7-ethyl-5-methyl-2-(1H-pyrrol-2-yl)-7,8-dihydro-6(5H)-pteridinone | C18H23N5O

(7R)-8-Cyclopentyl-7-ethyl-5-methyl-2-(1H-pyrrol-2-yl)-7,8-dihydro-6(5H)-pteridinone

  • Molecular FormulaC18H23N5O
  • Average mass325.408 Da
  • Monoisotopic mass325.190247 Da
  • ChemSpider ID35033593

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(7R)-8-Cyclopentyl-7-ethyl-5-methyl-2-(1H-pyrrol-2-yl)-7,8-dihydro-6(5H)-pteridinon [German] [ACD/IUPAC Name]
(7R)-8-Cyclopentyl-7-ethyl-5-methyl-2-(1H-pyrrol-2-yl)-7,8-dihydro-6(5H)-pteridinone [ACD/IUPAC Name]
(7R)-8-Cyclopentyl-7-éthyl-5-méthyl-2-(1H-pyrrol-2-yl)-7,8-dihydro-6(5H)-ptéridinone [French] [ACD/IUPAC Name]
(7r)-8-Cyclopentyl-7-Ethyl-5-Methyl-2-(1h-Pyrrol-2-Yl)-7,8-Dihydropteridin-6(5h)-One
6(5H)-Pteridinone, 8-cyclopentyl-7-ethyl-7,8-dihydro-5-methyl-2-(1H-pyrrol-2-yl)-, (7R)- [ACD/Index Name]
1D1

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

Density: 1.2±0.1 g/cm3
Boiling Point: 527.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 273.0±30.1 °C
Index of Refraction: 1.607
Molar Refractivity: 91.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.56
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 29.90
ACD/KOC (pH 5.5): 385.01
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 33.00
ACD/KOC (pH 7.4): 425.04
Polar Surface Area: 65 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 264.9±3.0 cm3

Click to predict properties on the Chemicalize site


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