Found 11 results

Search term: MF = 'C_{37}H_{57}N_{3}O'
ChemSpider 2D Image | 4-[4-(Dibenzylamino)butyl]octadecahydropyrido[1,2-e][1,5]diazacycloheptadecin-5(6H)-one | C37H57N3O

4-[4-(Dibenzylamino)butyl]octadecahydropyrido[1,2-e][1,5]diazacycloheptadecin-5(6H)-one

  • Molecular FormulaC37H57N3O
  • Average mass559.868 Da
  • Monoisotopic mass559.450134 Da
  • ChemSpider ID9401803

More details:

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

4-[4-(Dibenzylamino)butyl]octadecahydropyrido[1,2-e][1,5]diazacycloheptadecin-5(6H)-on [German] [ACD/IUPAC Name]
4-[4-(Dibenzylamino)butyl]octadecahydropyrido[1,2-e][1,5]diazacycloheptadecin-5(6H)-one [ACD/IUPAC Name]
4-[4-(Dibenzylamino)butyl]octadécahydropyrido[1,2-e][1,5]diazacycloheptadécin-5(6H)-one [French] [ACD/IUPAC Name]
Pyrido[1,2-e][1,5]diazacycloheptadecin-5(6H)-one, 4-[4-[bis(phenylmethyl)amino]butyl]octadecahydro- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 682.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 246.9±22.5 °C
Index of Refraction: 1.568
Molar Refractivity: 174.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 10.25
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 87.54
ACD/KOC (pH 5.5): 59.45
ACD/LogD (pH 7.4): 5.60
ACD/BCF (pH 7.4): 2504.34
ACD/KOC (pH 7.4): 1700.71
Polar Surface Area: 27 Å2
Polarizability: 69.3±0.5 10-24cm3
Surface Tension: 47.5±5.0 dyne/cm
Molar Volume: 534.3±5.0 cm3

Click to predict properties on the Chemicalize site


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