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Search term: TXIOKRWXRUIBEA-IBGZPJMESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | [(3S)-3-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperidinyl](2-naphthyl)methanone | C22H21N5O

[(3S)-3-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperidinyl](2-naphthyl)methanone

  • Molecular FormulaC22H21N5O
  • Average mass371.435 Da
  • Monoisotopic mass371.174622 Da
  • ChemSpider ID59053235

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(3S)-3-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperidinyl](2-naphthyl)methanon [German] [ACD/IUPAC Name]
[(3S)-3-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperidinyl](2-naphthyl)methanone [ACD/IUPAC Name]
[(3S)-3-(5-Méthyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-pipéridinyl](2-naphtyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [(3S)-3-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperidinyl]-2-naphthalenyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.719
Molar Refractivity: 108.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.49
ACD/KOC (pH 5.5): 616.72
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.49
ACD/KOC (pH 7.4): 616.79
Polar Surface Area: 63 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 56.0±7.0 dyne/cm
Molar Volume: 276.1±7.0 cm3

Click to predict properties on the Chemicalize site


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