ChemSpider 2D Image | LTX-109 | C43H69N11O3

LTX-109

  • Molecular FormulaC43H69N11O3
  • Average mass788.080 Da
  • Monoisotopic mass787.558472 Da
  • ChemSpider ID26611002

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1166254-80-3 [RN]
HO813QDF65
L-Argininamide, L-arginyl-2,5,7-tris(1,1-dimethylethyl)-L-tryptophyl-N-(2-phenylethyl)- [ACD/Index Name]
L-Arginyl-2,5,7-tris(1,1-dimethylethyl)-L-tryptophyl-N-(2-phenylethyl)-L-argininamide
L-Arginyl-2,5,7-tris(2-methyl-2-propanyl)-L-tryptophyl-N-(2-phenylethyl)-L-argininamid [German] [ACD/IUPAC Name]
L-Arginyl-2,5,7-tris(2-methyl-2-propanyl)-L-tryptophyl-N-(2-phenylethyl)-L-argininamide [ACD/IUPAC Name]
L-Arginyl-2,5,7-tris(2-méthyl-2-propanyl)-L-tryptophyl-N-(2-phényléthyl)-L-argininamide [French] [ACD/IUPAC Name]
LTX-109
(2S)-2-amino-5-(diaminomethylideneamino)-N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-oxo-1-(2-phenylethylamino)pentan-2-yl]amino]-1-oxo-3-(2,5,7-tritert-butyl-1H-indol-3-yl)propan-2-yl]pentanamide
L-arginyl-2,5,7-tri-tert-butyl-L-tryptophyl-N-(2-phenylethyl)-L-argininamide
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.604
Molar Refractivity: 223.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 14
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 4
ACD/LogP: 5.23
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 253 Å2
Polarizability: 88.6±0.5 10-24cm3
Surface Tension: 46.8±7.0 dyne/cm
Molar Volume: 649.3±7.0 cm3

Click to predict properties on the Chemicalize site


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