Found 1 result

Search term: XCNMPRNFAWIILX-SANMLTNESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-{[2-Oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinolinyl]oxy}-N-[(1S)-1-phenylpropyl]acetamide | C31H29N3O3S

2-{[2-Oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinolinyl]oxy}-N-[(1S)-1-phenylpropyl]acetamide

  • Molecular FormulaC31H29N3O3S
  • Average mass523.645 Da
  • Monoisotopic mass523.192932 Da
  • ChemSpider ID26368679

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-{[2-Oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-chinolinyl]oxy}-N-[(1S)-1-phenylpropyl]acetamid [German] [ACD/IUPAC Name]
2-{[2-Oxo-4-(2-phényléthyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinoléinyl]oxy}-N-[(1S)-1-phénylpropyl]acétamide [French] [ACD/IUPAC Name]
2-{[2-Oxo-4-(2-phenylethyl)-3-(1,3-thiazol-2-yl)-1,2-dihydro-6-quinolinyl]oxy}-N-[(1S)-1-phenylpropyl]acetamide [ACD/IUPAC Name]
Acetamide, 2-[[1,2-dihydro-2-oxo-4-(2-phenylethyl)-3-(2-thiazolyl)-6-quinolinyl]oxy]-N-[(1S)-1-phenylpropyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.629
Molar Refractivity: 149.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.07
ACD/LogD (pH 5.5): 5.17
ACD/BCF (pH 5.5): 4999.66
ACD/KOC (pH 5.5): 15461.27
ACD/LogD (pH 7.4): 5.17
ACD/BCF (pH 7.4): 4970.04
ACD/KOC (pH 7.4): 15369.67
Polar Surface Area: 109 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 420.6±3.0 cm3

Click to predict properties on the Chemicalize site


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