ChemSpider 2D Image | 2,7-Bis[3-(4-morpholinyl)propyl]-4-{[2-(1-pyrrolidinyl)ethyl]amino}-9-[4-(1-pyrrolidinylmethyl)phenyl]benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone | C45H57N7O6

2,7-Bis[3-(4-morpholinyl)propyl]-4-{[2-(1-pyrrolidinyl)ethyl]amino}-9-[4-(1-pyrrolidinylmethyl)phenyl]benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone

  • Molecular FormulaC45H57N7O6
  • Average mass791.977 Da
  • Monoisotopic mass791.437012 Da
  • ChemSpider ID123963087

More details:

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

2,7-Bis[3-(4-morpholinyl)propyl]-4-{[2-(1-pyrrolidinyl)ethyl]amino}-9-[4-(1-pyrrolidinylmethyl)phenyl]benzo[lmn][3,8]phenanthrolin-1,3,6,8(2H,7H)-tetron [German] [ACD/IUPAC Name]
2,7-Bis[3-(4-morpholinyl)propyl]-4-{[2-(1-pyrrolidinyl)ethyl]amino}-9-[4-(1-pyrrolidinylmethyl)phenyl]benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone [ACD/IUPAC Name]
2,7-Bis[3-(4-morpholinyl)propyl]-4-{[2-(1-pyrrolidinyl)éthyl]amino}-9-[4-(1-pyrrolidinylméthyl)phényl]benzo[lmn][3,8]phénanthroline-1,3,6,8(2H,7H)-tétrone [French] [ACD/IUPAC Name]
Benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone, 2,7-bis[3-(4-morpholinyl)propyl]-4-[[2-(1-pyrrolidinyl)ethyl]amino]-9-[4-(1-pyrrolidinylmethyl)phenyl]- [ACD/Index Name]
SOP1812

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.644
Molar Refractivity: 221.8±0.3 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 0.53
ACD/LogD (pH 5.5): -4.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 118 Å2
Polarizability: 87.9±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 612.9±3.0 cm3

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