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Search term: UISOENIWYLOUIG-SREBMQDQCM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Ethyl N-({2-[1-(3-phenyl-2-propynoyl)-4-piperidinyl]-1,3-thiazol-4-yl}carbonyl)phenylalaninate | C29H29N3O4S

Ethyl N-({2-[1-(3-phenyl-2-propynoyl)-4-piperidinyl]-1,3-thiazol-4-yl}carbonyl)phenylalaninate

  • Molecular FormulaC29H29N3O4S
  • Average mass515.623 Da
  • Monoisotopic mass515.187866 Da
  • ChemSpider ID2812122

More details:

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

Ethyl N-({2-[1-(3-phenyl-2-propynoyl)-4-piperidinyl]-1,3-thiazol-4-yl}carbonyl)phenylalaninate [ACD/IUPAC Name]
Ethyl-N-({2-[1-(3-phenyl-2-propynoyl)-4-piperidinyl]-1,3-thiazol-4-yl}carbonyl)phenylalaninat [German] [ACD/IUPAC Name]
N-({2-[1-(3-Phényl-2-propynoyl)-4-pipéridinyl]-1,3-thiazol-4-yl}carbonyl)phénylalaninate d'éthyle [French] [ACD/IUPAC Name]
Phenylalanine, N-[[2-[1-(1-oxo-3-phenyl-2-propyn-1-yl)-4-piperidinyl]-4-thiazolyl]carbonyl]-, ethyl ester [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: 1.640
Molar Refractivity: 142.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 4.31
ACD/BCF (pH 5.5): 1108.60
ACD/KOC (pH 5.5): 5260.74
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 1108.60
ACD/KOC (pH 7.4): 5260.74
Polar Surface Area: 117 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 65.4±5.0 dyne/cm
Molar Volume: 395.7±5.0 cm3

Click to predict properties on the Chemicalize site


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