Found 1903 results

Search term: MF = 'C_{29}H_{37}N_{3}O_{6}'
ChemSpider 2D Image | N-{[1-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)-4-piperidinyl]carbonyl}-L-phenylalanine | C29H37N3O6

N-{[1-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)-4-piperidinyl]carbonyl}-L-phenylalanine

  • Molecular FormulaC29H37N3O6
  • Average mass523.621 Da
  • Monoisotopic mass523.268250 Da
  • ChemSpider ID17466342

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Phenylalanine, N-[[1-[(2S)-2-[[(1,1-dimethylethoxy)carbonyl]amino]-1-oxo-3-phenylpropyl]-4-piperidinyl]carbonyl]- [ACD/Index Name]
N-{[1-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)-4-piperidinyl]carbonyl}-L-phenylalanin [German] [ACD/IUPAC Name]
N-{[1-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)-4-piperidinyl]carbonyl}-L-phenylalanine [ACD/IUPAC Name]
N-{[1-(N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-L-phénylalanyl)-4-pipéridinyl]carbonyl}-L-phénylalanine [French] [ACD/IUPAC Name]
(2S)-2-({1-[(2S)-2-[(TERT-BUTOXYCARBONYL)AMINO]-3-PHENYLPROPANOYL]PIPERIDIN-4-YL}FORMAMIDO)-3-PHENYLPROPANOIC ACID
(2S)-2-({1-[(2S)-2-{[(TERT-BUTOXY)CARBONYL]AMINO}-3-PHENYLPROPANOYL]PIPERIDIN-4-YL}FORMAMIDO)-3-PHENYLPROPANOIC ACID
(S)-2-(1-((S)-2-((tert-butoxycarbonyl)amino)-3-phenylpropanoyl)piperidine-4-carboxamido)-3-phenylpropanoic acid
956942-39-5 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 786.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.9 mmHg at 25°C
    Enthalpy of Vaporization: 120.0±3.0 kJ/mol
    Flash Point: 429.5±32.9 °C
    Index of Refraction: 1.572
    Molar Refractivity: 141.5±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 1
    ACD/LogP: 4.13
    ACD/LogD (pH 5.5): 1.28
    ACD/BCF (pH 5.5): 1.62
    ACD/KOC (pH 5.5): 11.43
    ACD/LogD (pH 7.4): -0.09
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 125 Å2
    Polarizability: 56.1±0.5 10-24cm3
    Surface Tension: 53.0±3.0 dyne/cm
    Molar Volume: 430.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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