Found 83 results

Search term: MF = 'C_{35}H_{38}N_{2}O_{5}S'
ChemSpider 2D Image | 1-Ethyl-3-{[4'-(4-[4-(hydroxymethyl)phenyl]-6-{[(2-methoxyphenyl)sulfanyl]methyl}-1,3-dioxan-2-yl)-2-biphenylyl]methyl}urea | C35H38N2O5S

1-Ethyl-3-{[4'-(4-[4-(hydroxymethyl)phenyl]-6-{[(2-methoxyphenyl)sulfanyl]methyl}-1,3-dioxan-2-yl)-2-biphenylyl]methyl}urea

  • Molecular FormulaC35H38N2O5S
  • Average mass598.752 Da
  • Monoisotopic mass598.250122 Da
  • ChemSpider ID3277060

More details:

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

1-Ethyl-3-{[4'-(4-[4-(hydroxymethyl)phenyl]-6-{[(2-methoxyphenyl)sulfanyl]methyl}-1,3-dioxan-2-yl)-2-biphenylyl]methyl}harnstoff [German] [ACD/IUPAC Name]
1-Ethyl-3-{[4'-(4-[4-(hydroxymethyl)phenyl]-6-{[(2-methoxyphenyl)sulfanyl]methyl}-1,3-dioxan-2-yl)-2-biphenylyl]methyl}urea [ACD/IUPAC Name]
1-Éthyl-3-{[4'-(4-[4-(hydroxyméthyl)phényl]-6-{[(2-méthoxyphényl)sulfanyl]méthyl}-1,3-dioxan-2-yl)-2-biphénylyl]méthyl}urée [French] [ACD/IUPAC Name]
Urea, N-ethyl-N'-[[4'-[4-[4-(hydroxymethyl)phenyl]-6-[[(2-methoxyphenyl)thio]methyl]-1,3-dioxan-2-yl][1,1'-biphenyl]-2-yl]methyl]- [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: 832.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.9±3.0 kJ/mol
Flash Point: 457.5±34.3 °C
Index of Refraction: 1.654
Molar Refractivity: 171.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.00
ACD/LogD (pH 5.5): 5.88
ACD/BCF (pH 5.5): 17397.78
ACD/KOC (pH 5.5): 37751.34
ACD/LogD (pH 7.4): 5.88
ACD/BCF (pH 7.4): 17397.76
ACD/KOC (pH 7.4): 37751.30
Polar Surface Area: 114 Å2
Polarizability: 68.1±0.5 10-24cm3
Surface Tension: 62.0±5.0 dyne/cm
Molar Volume: 468.8±5.0 cm3

Click to predict properties on the Chemicalize site


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