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Search term: NLYFSJWBMSCWSU-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 8-{4-[2-(4-{4-[2-(4-Morpholinyl)ethyl]phenyl}-1-piperidinyl)ethyl]-1H-pyrazol-1-yl}pyrido[3,4-d]pyrimidin-4(3H)-one | C29H35N7O2

8-{4-[2-(4-{4-[2-(4-Morpholinyl)ethyl]phenyl}-1-piperidinyl)ethyl]-1H-pyrazol-1-yl}pyrido[3,4-d]pyrimidin-4(3H)-one

  • Molecular FormulaC29H35N7O2
  • Average mass513.634 Da
  • Monoisotopic mass513.285217 Da
  • ChemSpider ID128715600

More details:

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

8-{4-[2-(4-{4-[2-(4-Morpholinyl)ethyl]phenyl}-1-piperidinyl)ethyl]-1H-pyrazol-1-yl}pyrido[3,4-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
8-{4-[2-(4-{4-[2-(4-Morpholinyl)ethyl]phenyl}-1-piperidinyl)ethyl]-1H-pyrazol-1-yl}pyrido[3,4-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
8-{4-[2-(4-{4-[2-(4-Morpholinyl)éthyl]phényl}-1-pipéridinyl)éthyl]-1H-pyrazol-1-yl}pyrido[3,4-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
Pyrido[3,4-d]pyrimidin-4(3H)-one, 8-[4-[2-[4-[4-[2-(4-morpholinyl)ethyl]phenyl]-1-piperidinyl]ethyl]-1H-pyrazol-1-yl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4466130/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 741.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.1±3.0 kJ/mol
Flash Point: 402.0±32.9 °C
Index of Refraction: 1.696
Molar Refractivity: 147.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.71
ACD/LogD (pH 5.5): -2.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.57
Polar Surface Area: 88 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 57.0±7.0 dyne/cm
Molar Volume: 382.6±7.0 cm3

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