ChemSpider 2D Image | Ethyl (2E)-1-butyl-2-[(2-ethoxy-1-naphthoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate | C31H30N4O5

Ethyl (2E)-1-butyl-2-[(2-ethoxy-1-naphthoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate

  • Molecular FormulaC31H30N4O5
  • Average mass538.594 Da
  • Monoisotopic mass538.221619 Da
  • ChemSpider ID1613348

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-Butyl-2-[(2-éthoxy-1-naphtoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
2H-Dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylic acid, 1-butyl-2-[[(2-ethoxy-1-naphthalenyl)carbonyl]imino]-1,5-dihydro-5-oxo-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-1-butyl-2-[(2-ethoxy-1-naphthoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate [ACD/IUPAC Name]
Ethyl-(2E)-1-butyl-2-[(2-ethoxy-1-naphthoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-3-carboxylat [German] [ACD/IUPAC Name]
(E)-ethyl 1-butyl-2-((2-ethoxy-1-naphthoyl)imino)-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
1-Butyl-2-(2-ethoxy-naphthalene-1-carbonylimino)-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid ethyl ester
685859-82-9 [RN]
ethyl (2E)-1-butyl-2-{[(2-ethoxynaphthalen-1-yl)carbonyl]imino}-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl (E)-1-butyl-2-((2-ethoxy-1-naphthoyl)imino)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxylate
MFCD04414613

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

UNM000000748501 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 697.0±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 102.1±3.0 kJ/mol
    Flash Point: 375.3±34.3 °C
    Index of Refraction: 1.638
    Molar Refractivity: 151.5±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 0
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 4.27
    ACD/LogD (pH 5.5): 4.06
    ACD/BCF (pH 5.5): 722.54
    ACD/KOC (pH 5.5): 3872.35
    ACD/LogD (pH 7.4): 4.06
    ACD/BCF (pH 7.4): 722.54
    ACD/KOC (pH 7.4): 3872.35
    Polar Surface Area: 101 Å2
    Polarizability: 60.0±0.5 10-24cm3
    Surface Tension: 49.5±7.0 dyne/cm
    Molar Volume: 421.5±7.0 cm3

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