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Search term: HMTLPOCMTKGSHR-SANMLTNESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-[(1R)-2-Hydroxy-1-phenylethyl]-2-{[2-oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinolinyl]oxy}acetamide | C30H27N3O4S

N-[(1R)-2-Hydroxy-1-phenylethyl]-2-{[2-oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinolinyl]oxy}acetamide

  • Molecular FormulaC30H27N3O4S
  • Average mass525.618 Da
  • Monoisotopic mass525.172241 Da
  • ChemSpider ID26368459

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acetamide, 2-[[1,2-dihydro-2-oxo-4-(2-phenylethyl)-3-(2-thiazolyl)-6-quinolinyl]oxy]-N-[(1R)-2-hydroxy-1-phenylethyl]- [ACD/Index Name]
N-[(1R)-2-Hydroxy-1-phenylethyl]-2-{[2-oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-chinolinyl]oxy}acetamid [German] [ACD/IUPAC Name]
N-[(1R)-2-Hydroxy-1-phényléthyl]-2-{[2-oxo-4-(2-phényléthyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinoléinyl]oxy}acétamide [French] [ACD/IUPAC Name]
N-[(1R)-2-Hydroxy-1-phenylethyl]-2-{[2-oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinolinyl]oxy}acetamide [ACD/IUPAC 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: 1.650
Molar Refractivity: 146.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 596.44
ACD/KOC (pH 5.5): 3375.22
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 592.88
ACD/KOC (pH 7.4): 3355.08
Polar Surface Area: 129 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 401.6±3.0 cm3

Click to predict properties on the Chemicalize site


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