Found 2 results

Search term: UGJOAVUFFONAPW (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3R)-12'-Methyl-3'H,15'H-spiro[indole-3,13'-[2,10,16]triazatetracyclo[10.2.2.0~2,11~.0~4,9~]hexadeca[4,6,8,10]tetraene]-3',15'-dione | C21H16N4O2

(3R)-12'-Methyl-3'H,15'H-spiro[indole-3,13'-[2,10,16]triazatetracyclo[10.2.2.02,11.04,9]hexadeca[4,6,8,10]tetraene]-3',15'-dione

  • Molecular FormulaC21H16N4O2
  • Average mass356.377 Da
  • Monoisotopic mass356.127319 Da
  • ChemSpider ID78441900

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

(3R)-12'-Methyl-3'H,15'H-spiro[indole-3,13'-[2,10,16]triazatetracyclo[10.2.2.02,11.04,9]hexadeca[4,6,8,10]tetraene]-3',15'-dione [ACD/IUPAC Name]
Alantrypinene B

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.822
Molar Refractivity: 99.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 6.87
ACD/KOC (pH 5.5): 137.57
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 7.00
ACD/KOC (pH 7.4): 140.14
Polar Surface Area: 74 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 70.7±7.0 dyne/cm
Molar Volume: 228.8±7.0 cm3

Click to predict properties on the Chemicalize site


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