ChemSpider 2D Image | (E)-1-[3-(Benzyloxy)-4-methoxyphenyl]-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]methanimine | C29H33N3O5S

(E)-1-[3-(Benzyloxy)-4-methoxyphenyl]-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]methanimine

  • Molecular FormulaC29H33N3O5S
  • Average mass535.654 Da
  • Monoisotopic mass535.214111 Da
  • ChemSpider ID2721913

  • Double-bond stereo - Double-bond stereo

More details:

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

(E)-1-[3-(Benzyloxy)-4-methoxyphenyl]-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]methanimin [German] [ACD/IUPAC Name]
(E)-1-[3-(Benzyloxy)-4-methoxyphenyl]-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]methanimine [ACD/IUPAC Name]
(E)-1-[3-(Benzyloxy)-4-méthoxyphényl]-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phényl]méthanimine [French] [ACD/IUPAC Name]
Benzenamine, N-[(1E)-[4-methoxy-3-(phenylmethoxy)phenyl]methylene]-5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)- [ACD/Index Name]
(1E)-1-[3-(BENZYLOXY)-4-METHOXYPHENYL]-N-[5-(MORPHOLINE-4-SULFONYL)-2-(PYRROLIDIN-1-YL)PHENYL]METHANIMINE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 744.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.5±3.0 kJ/mol
Flash Point: 403.7±35.7 °C
Index of Refraction: 1.621
Molar Refractivity: 148.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.12
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 981.04
ACD/KOC (pH 5.5): 4766.98
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1019.49
ACD/KOC (pH 7.4): 4953.81
Polar Surface Area: 89 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 421.4±7.0 cm3

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