Found 154 results

Search term: MF = 'C_{29}H_{40}N_{4}O_{7}'
ChemSpider 2D Image | N-{[(2R)-2-(Tyrosylamino)propoxy]acetyl}-L-phenylalanyl-L-leucine | C29H40N4O7

N-{[(2R)-2-(Tyrosylamino)propoxy]acetyl}-L-phenylalanyl-L-leucine

  • Molecular FormulaC29H40N4O7
  • Average mass556.651 Da
  • Monoisotopic mass556.289673 Da
  • ChemSpider ID23170577

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

L-Leucine, N-[2-[(2R)-2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]propoxy]acetyl]-L-phenylalanyl- [ACD/Index Name]
N-({[(2R)-2-(tyrosylamino)propyl]oxy}acetyl)-L-phenylalanyl-L-leucine
N-{[(2R)-2-(Tyrosylamino)propoxy]acetyl}-L-phenylalanyl-L-leucin [German] [ACD/IUPAC Name]
N-{[(2R)-2-(Tyrosylamino)propoxy]acetyl}-L-phenylalanyl-L-leucine [ACD/IUPAC Name]
N-{2-[(2R)-2-(Tyrosylamino)propoxy]acétyl}-L-phénylalanyl-L-leucine [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL311677/
Tyr-d-Ala-Gly-Phe-Leu

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

Density: 1.2±0.1 g/cm3
Boiling Point: 909.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 138.5±3.0 kJ/mol
Flash Point: 503.8±34.3 °C
Index of Refraction: 1.572
Molar Refractivity: 149.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 2.56
ACD/LogD (pH 5.5): -0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 180 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 453.3±3.0 cm3

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