Found 1 result

Search term: VYBRSTDIXMSCGM-QFIPXVFZSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 8-(4-Fluoro-3-{[(2R)-2-phenyl-1-piperazinyl]carbonyl}benzyl)-2,3,4,6-tetrahydropyrido[2,3-d]pyridazin-5(1H)-one | C25H26FN5O2

8-(4-Fluoro-3-{[(2R)-2-phenyl-1-piperazinyl]carbonyl}benzyl)-2,3,4,6-tetrahydropyrido[2,3-d]pyridazin-5(1H)-one

  • Molecular FormulaC25H26FN5O2
  • Average mass447.505 Da
  • Monoisotopic mass447.207062 Da
  • ChemSpider ID28511680

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

8-(4-Fluor-3-{[(2R)-2-phenyl-1-piperazinyl]carbonyl}benzyl)-2,3,4,6-tetrahydropyrido[2,3-d]pyridazin-5(1H)-on [German] [ACD/IUPAC Name]
8-(4-Fluoro-3-{[(2R)-2-phenyl-1-piperazinyl]carbonyl}benzyl)-2,3,4,6-tetrahydropyrido[2,3-d]pyridazin-5(1H)-one [ACD/IUPAC Name]
8-(4-Fluoro-3-{[(2R)-2-phényl-1-pipérazinyl]carbonyl}benzyl)-2,3,4,6-tétrahydropyrido[2,3-d]pyridazin-5(1H)-one [French] [ACD/IUPAC Name]
Pyrido[2,3-d]pyridazin-5(1H)-one, 8-[[4-fluoro-3-[[(2R)-2-phenyl-1-piperazinyl]carbonyl]phenyl]methyl]-2,3,4,6-tetrahydro- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.696
Molar Refractivity: 122.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.20
ACD/LogD (pH 5.5): -1.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.07
ACD/KOC (pH 7.4): 23.25
Polar Surface Area: 86 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 55.3±7.0 dyne/cm
Molar Volume: 319.2±7.0 cm3

Click to predict properties on the Chemicalize site


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