Found 1939 results

Search term: MF = 'C_{30}H_{33}NO_{6}'
ChemSpider 2D Image | TCMDC-125638 | C30H33NO6

TCMDC-125638

  • Molecular FormulaC30H33NO6
  • Average mass503.586 Da
  • Monoisotopic mass503.230774 Da
  • ChemSpider ID2393730

More details:

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

3-Quinolinecarboxylic acid, 7-(3,4-dimethoxyphenyl)-1,4,5,6,7,8-hexahydro-4-(3-hydroxyphenyl)-2-methyl-5-oxo-, cyclopentyl ester [ACD/Index Name]
7-(3,4-Diméthoxyphényl)-4-(3-hydroxyphényl)-2-méthyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinoléinecarboxylate de cyclopentyle [French] [ACD/IUPAC Name]
Cyclopentyl 7-(3,4-dimethoxyphenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate [ACD/IUPAC Name]
Cyclopentyl 7-(3,4-dimethoxyphenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Cyclopentyl-7-(3,4-dimethoxyphenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-chinolincarboxylat [German] [ACD/IUPAC Name]
TCMDC-125638
CYCLOPENTYL 7-(3,4-DIMETHOXYPHENYL)-4-(3-HYDROXYPHENYL)-2-METHYL-5-OXO-4,6,7,8-TETRAHYDRO-1H-QUINOLINE-3-CARBOXYLATE

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

BAS 02374568 [DBID]
  • Miscellaneous

    • Bio Activity:

      XC50_3D7 (uM) (Plasmodium Falciparum, Malaria): 0.216397407 GlaxoSmithKline Malaria Set

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

Density: 1.3±0.1 g/cm3
Boiling Point: 674.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 361.6±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 138.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 1219.06
ACD/KOC (pH 5.5): 5630.72
ACD/LogD (pH 7.4): 4.36
ACD/BCF (pH 7.4): 1212.71
ACD/KOC (pH 7.4): 5601.42
Polar Surface Area: 94 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 58.2±5.0 dyne/cm
Molar Volume: 389.5±5.0 cm3

Click to predict properties on the Chemicalize site


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