ChemSpider 2D Image | (4Z)-4-({4-[2-(Diethylamino)ethyl]-3,5-dimethyl-1H-pyrrol-2-yl}methylene)-5-(2-pyrazinyl)-2,4-dihydro-3H-pyrazol-3-one | C20H26N6O

(4Z)-4-({4-[2-(Diethylamino)ethyl]-3,5-dimethyl-1H-pyrrol-2-yl}methylene)-5-(2-pyrazinyl)-2,4-dihydro-3H-pyrazol-3-one

  • Molecular FormulaC20H26N6O
  • Average mass366.460 Da
  • Monoisotopic mass366.216797 Da
  • ChemSpider ID23251475

  • Double-bond stereo - Double-bond stereo

More details:

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

(4Z)-4-({4-[2-(Diethylamino)ethyl]-3,5-dimethyl-1H-pyrrol-2-yl}methylen)-5-(2-pyrazinyl)-2,4-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
(4Z)-4-({4-[2-(Diethylamino)ethyl]-3,5-dimethyl-1H-pyrrol-2-yl}methylene)-5-(2-pyrazinyl)-2,4-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
(4Z)-4-({4-[2-(Diéthylamino)éthyl]-3,5-diméthyl-1H-pyrrol-2-yl}méthylène)-5-(2-pyrazinyl)-2,4-dihydro-3H-pyrazol-3-one [French] [ACD/IUPAC Name]
(4Z)-4-({4-[2-(diethylamino)ethyl]-3,5-dimethyl-1H-pyrrol-2-yl}methylidene)-5-(pyrazin-2-yl)-2,4-dihydro-3H-pyrazol-3-one
3H-Pyrazol-3-one, 4-[[4-[2-(diethylamino)ethyl]-3,5-dimethyl-1H-pyrrol-2-yl]methylene]-2,4-dihydro-5-(2-pyrazinyl)-, (4Z)- [ACD/Index Name]
(4Z)-4-[[4-(2-diethylaminoethyl)-3,5-dimethyl-1H-pyrrol-2-yl]methylene]-3-pyrazin-2-yl-1H-pyrazol-5-one
4-[4-(2-Diethylamino-ethyl)-3,5-dimethyl-1H-pyrrol-2-ylmethylene]-5-pyrazin-2-yl-2,4-dihydro-pyrazol-3-one
CHEMBL425356
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL425356/

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.635
Molar Refractivity: 106.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): -1.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 86 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 45.3±7.0 dyne/cm
Molar Volume: 297.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement