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Search term: RTCNQSGQNAAYMT-HOTGVXAUSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-[(Methylsulfanyl)acetyl]-L-leucyl-N-methyl-L-phenylalaninamide | C19H29N3O3S

N-[(Methylsulfanyl)acetyl]-L-leucyl-N-methyl-L-phenylalaninamide

  • Molecular FormulaC19H29N3O3S
  • Average mass379.517 Da
  • Monoisotopic mass379.192963 Da
  • ChemSpider ID24683481

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Phenylalaninamide, N-[2-(methylthio)acetyl]-L-leucyl-N-methyl- [ACD/Index Name]
N-[(Methylsulfanyl)acetyl]-L-leucyl-N-methyl-L-phenylalaninamid [German] [ACD/IUPAC Name]
N-[(Methylsulfanyl)acetyl]-L-leucyl-N-methyl-L-phenylalaninamide [ACD/IUPAC Name]
N-[2-(Méthylsulfanyl)acétyl]-L-leucyl-N-méthyl-L-phénylalaninamide [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL353472/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 689.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.0±3.0 kJ/mol
Flash Point: 370.7±31.5 °C
Index of Refraction: 1.539
Molar Refractivity: 105.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.69
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 12.22
ACD/KOC (pH 5.5): 208.79
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 12.22
ACD/KOC (pH 7.4): 208.79
Polar Surface Area: 113 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 336.7±3.0 cm3

Click to predict properties on the Chemicalize site


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