Found 5 results

Search term: MF = 'C_{30}H_{49}N_{5}O_{6}S'
ChemSpider 2D Image | N-(4-Morpholinylacetyl)-L-leucyl-N-[(2S,3E)-1-[4-(aminomethyl)phenyl]-4-(methylsulfonyl)-3-buten-2-yl]-L-leucinamide | C30H49N5O6S

N-(4-Morpholinylacetyl)-L-leucyl-N-[(2S,3E)-1-[4-(aminomethyl)phenyl]-4-(methylsulfonyl)-3-buten-2-yl]-L-leucinamide

  • Molecular FormulaC30H49N5O6S
  • Average mass607.805 Da
  • Monoisotopic mass607.340332 Da
  • ChemSpider ID128438175

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Leucinamide, N-[2-(4-morpholinyl)acetyl]-L-leucyl-N-[(1S,2E)-1-[[4-(aminomethyl)phenyl]methyl]-3-(methylsulfonyl)-2-propen-1-yl]- [ACD/Index Name]
N-(4-Morpholinylacetyl)-L-leucyl-N-[(2S,3E)-1-[4-(aminomethyl)phenyl]-4-(methylsulfonyl)-3-buten-2-yl]-L-leucinamid [German] [ACD/IUPAC Name]
N-(4-Morpholinylacetyl)-L-leucyl-N-[(2S,3E)-1-[4-(aminomethyl)phenyl]-4-(methylsulfonyl)-3-buten-2-yl]-L-leucinamide [ACD/IUPAC Name]
N-[2-(4-Morpholinyl)acétyl]-L-leucyl-N-[(2S,3E)-1-[4-(aminométhyl)phényl]-4-(méthylsulfonyl)-3-butén-2-yl]-L-leucinamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 914.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 133.1±3.0 kJ/mol
Flash Point: 507.0±34.3 °C
Index of Refraction: 1.545
Molar Refractivity: 165.0±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 2.87
ACD/LogD (pH 5.5): -1.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.70
Polar Surface Area: 168 Å2
Polarizability: 65.4±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 521.8±3.0 cm3

Click to predict properties on the Chemicalize site


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