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Search term: MORUSKYOVHFQPY-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | [2-Allyl-4-(ethylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indol-7-yl](4-methyl-1-piperidinyl)methanone | C22H29N3O3S

[2-Allyl-4-(ethylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indol-7-yl](4-methyl-1-piperidinyl)methanone

  • Molecular FormulaC22H29N3O3S
  • Average mass415.549 Da
  • Monoisotopic mass415.192963 Da
  • ChemSpider ID23308091

More details:

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

[2-Allyl-4-(ethylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indol-7-yl](4-methyl-1-piperidinyl)methanon [German] [ACD/IUPAC Name]
[2-Allyl-4-(ethylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indol-7-yl](4-methyl-1-piperidinyl)methanone [ACD/IUPAC Name]
[2-Allyl-4-(éthylsulfonyl)-1,2,3,4-tétrahydropyrrolo[3,4-b]indol-7-yl](4-méthyl-1-pipéridinyl)méthanone [French] [ACD/IUPAC Name]
[4-(ethylsulfonyl)-2-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indol-7-yl](4-methylpiperidin-1-yl)methanone
Methanone, [4-(ethylsulfonyl)-1,2,3,4-tetrahydro-2-(2-propen-1-yl)pyrrolo[3,4-b]indol-7-yl](4-methyl-1-piperidinyl)- [ACD/Index Name]
(2-allyl-4-(ethylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indol-7-yl)(4-methylpiperidin-1-yl)methanone
CHEMBL250608

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

Density: 1.3±0.1 g/cm3
Boiling Point: 588.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 309.6±32.9 °C
Index of Refraction: 1.643
Molar Refractivity: 115.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 13.75
ACD/KOC (pH 5.5): 155.30
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 50.66
ACD/KOC (pH 7.4): 572.13
Polar Surface Area: 71 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 50.2±7.0 dyne/cm
Molar Volume: 319.8±7.0 cm3

Click to predict properties on the Chemicalize site


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