Found 34 results

Search term: MF = 'C_{23}H_{35}N_{3}O_{8}S'
ChemSpider 2D Image | Ethyl 4-(N-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}valyl)-1-piperazinecarboxylate | C23H35N3O8S

Ethyl 4-(N-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}valyl)-1-piperazinecarboxylate

  • Molecular FormulaC23H35N3O8S
  • Average mass513.604 Da
  • Monoisotopic mass513.214478 Da
  • ChemSpider ID121704783

More details:

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

1-Piperazinecarboxylic acid, 4-[2-[[3-[(3,4-dimethoxyphenyl)sulfonyl]-1-oxopropyl]amino]-3-methyl-1-oxobutyl]-, ethyl ester [ACD/Index Name]
4-(N-{3-[(3,4-Diméthoxyphényl)sulfonyl]propanoyl}valyl)-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-(N-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}valyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-(N-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}valyl)-1-piperazincarboxylat [German] [ACD/IUPAC 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: 746.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.8±3.0 kJ/mol
Flash Point: 405.3±32.9 °C
Index of Refraction: 1.537
Molar Refractivity: 129.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 10.03
ACD/KOC (pH 5.5): 181.32
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 10.03
ACD/KOC (pH 7.4): 181.32
Polar Surface Area: 140 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 413.9±3.0 cm3

Click to predict properties on the Chemicalize site


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