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Search term: KIBDJJXRHBWQSZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-{1-[3-(4-Acetyl-1-piperidinyl)-3-phenylpropyl]-4-piperidinyl}-N-ethyl-2-[4-(methylsulfonyl)phenyl]acetamide | C32H45N3O4S

N-{1-[3-(4-Acetyl-1-piperidinyl)-3-phenylpropyl]-4-piperidinyl}-N-ethyl-2-[4-(methylsulfonyl)phenyl]acetamide

  • Molecular FormulaC32H45N3O4S
  • Average mass567.782 Da
  • Monoisotopic mass567.313049 Da
  • ChemSpider ID2280691

More details:

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

Benzeneacetamide, N-[1-[3-(4-acetyl-1-piperidinyl)-3-phenylpropyl]-4-piperidinyl]-N-ethyl-4-(methylsulfonyl)- [ACD/Index Name]
N-{1-[3-(4-Acetyl-1-piperidinyl)-3-phenylpropyl]-4-piperidinyl}-N-ethyl-2-[4-(methylsulfonyl)phenyl]acetamid [German] [ACD/IUPAC Name]
N-{1-[3-(4-Acetyl-1-piperidinyl)-3-phenylpropyl]-4-piperidinyl}-N-ethyl-2-[4-(methylsulfonyl)phenyl]acetamide [ACD/IUPAC Name]
N-{1-[3-(4-Acétyl-1-pipéridinyl)-3-phénylpropyl]-4-pipéridinyl}-N-éthyl-2-[4-(méthylsulfonyl)phényl]acétamide [French] [ACD/IUPAC Name]

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

AIDS218091 [DBID]
AIDS-218091 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 741.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.2±3.0 kJ/mol
Flash Point: 402.4±32.9 °C
Index of Refraction: 1.599
Molar Refractivity: 160.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.42
ACD/LogD (pH 5.5): -1.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.39
ACD/BCF (pH 7.4): 3.16
ACD/KOC (pH 7.4): 32.41
Polar Surface Area: 86 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 55.1±5.0 dyne/cm
Molar Volume: 470.3±5.0 cm3

Click to predict properties on the Chemicalize site


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