ChemSpider 2D Image | Cyclo(L-leucyl-L-leucyl-L-leucyl-L-leucyl-D-tyrosyl) | C33H53N5O6

Cyclo(L-leucyl-L-leucyl-L-leucyl-L-leucyl-D-tyrosyl)

  • Molecular FormulaC33H53N5O6
  • Average mass615.804 Da
  • Monoisotopic mass615.399597 Da
  • ChemSpider ID23286517

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

Cyclo(L-leucyl-L-leucyl-L-leucyl-L-leucyl-D-tyrosyl) [ACD/Index Name] [ACD/IUPAC Name]
Cyclo(L-leucyl-L-leucyl-L-leucyl-L-leucyl-D-tyrosyl) [German] [ACD/Index Name] [ACD/IUPAC Name]
Cyclo(L-leucyl-L-leucyl-L-leucyl-L-leucyl-D-tyrosyl) [French] [ACD/Index Name] [ACD/IUPAC Name]
(3R,6S,9S,12S,15S)-3-(4-hydroxy-benzyl)-6,9,12,15-tetraisobutyl-1,4,7,10,13pentaaza-cyclopentadecane-2,5,8,11,14-pentaone
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL388295/

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

Density: 1.0±0.1 g/cm3
Boiling Point: 940.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.5±3.0 kJ/mol
Flash Point: 522.3±34.3 °C
Index of Refraction: 1.485
Molar Refractivity: 168.8±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 4.15
ACD/LogD (pH 5.5): 3.14
ACD/BCF (pH 5.5): 143.81
ACD/KOC (pH 5.5): 1218.63
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 143.36
ACD/KOC (pH 7.4): 1214.78
Polar Surface Area: 166 Å2
Polarizability: 66.9±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 589.3±3.0 cm3

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