Found 83 results

Search term: MF = 'C_{35}H_{38}N_{2}O_{5}S'
ChemSpider 2D Image | N-[5-tert-butyl-4-({6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-2-(propan-2-yl)-3,4-dihydro-2H-pyran-5-yl}sulfanyl)-2-methylphenyl]-3-cyanobenzamide | C35H38N2O5S

N-[5-tert-butyl-4-({6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-2-(propan-2-yl)-3,4-dihydro-2H-pyran-5-yl}sulfanyl)-2-methylphenyl]-3-cyanobenzamide

  • Molecular FormulaC35H38N2O5S
  • Average mass598.752 Da
  • Monoisotopic mass598.250122 Da
  • ChemSpider ID414752

More details:

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

3-Cyan-N-[4-({6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-4-oxo-3,4-dihydro-2H-pyran-5-yl}sulfanyl)-2-methyl-5-(2-methyl-2-propanyl)phenyl]benzamid [German] [ACD/IUPAC Name]
3-Cyano-N-[4-({6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-4-oxo-3,4-dihydro-2H-pyran-5-yl}sulfanyl)-2-methyl-5-(2-methyl-2-propanyl)phenyl]benzamide [ACD/IUPAC Name]
3-Cyano-N-[4-({6-hydroxy-2-[2-(4-hydroxyphényl)éthyl]-2-isopropyl-4-oxo-3,4-dihydro-2H-pyran-5-yl}sulfanyl)-2-méthyl-5-(2-méthyl-2-propanyl)phényl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-cyano-N-[4-[[3,4-dihydro-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-(1-methylethyl)-4-oxo-2H-pyran-5-yl]thio]-5-(1,1-dimethylethyl)-2-methylphenyl]- [ACD/Index Name]
N-[5-tert-butyl-4-({6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-2-(propan-2-yl)-3,4-dihydro-2H-pyran-5-yl}sulfanyl)-2-methylphenyl]-3-cyanobenzamide
N-(5-(tert-Butyl)-4-{4-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-6-(methylethyl)-2-oxo(5,6-dihydro-2H-pyran-3-ylthio)}-2-methylphenyl)(3-cyanophenyl)carboxamide
N-(5-tert-Butyl-4-{4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-6-isopropyl-2-oxo-5,6-dihydro-2H-pyran-3-ylsulfanyl}-2-methyl-phenyl)-3-cyano-benzamide

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

AIDS072526 [DBID]
AIDS-072526 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 663.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.5±3.0 kJ/mol
Flash Point: 354.8±31.5 °C
Index of Refraction: 1.643
Molar Refractivity: 168.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 1965.63
ACD/KOC (pH 5.5): 4013.25
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 33.83
ACD/KOC (pH 7.4): 69.08
Polar Surface Area: 145 Å2
Polarizability: 67.0±0.5 10-24cm3
Surface Tension: 63.6±5.0 dyne/cm
Molar Volume: 467.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement