Found 1 result

Search term: ZBJNAHVLKNFOPP-GAGJGVLVSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(1-Azepanylcarbonyl)-L-leucyltryptophyl-D-tryptophan | C35H44N6O5

N-(1-Azepanylcarbonyl)-L-leucyltryptophyl-D-tryptophan

  • Molecular FormulaC35H44N6O5
  • Average mass628.761 Da
  • Monoisotopic mass628.337341 Da
  • ChemSpider ID110293

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

D-Tryptophan, N-[(hexahydro-1H-azepin-1-yl)carbonyl]-L-leucyltryptophyl- [ACD/Index Name]
N-(1-Azepanylcarbonyl)-L-leucyltryptophyl-D-tryptophan [ACD/IUPAC Name]
N-(1-Azepanylcarbonyl)-L-leucyltryptophyl-D-tryptophan [German] [ACD/IUPAC Name]
N-(1-Azépanylcarbonyl)-L-leucyltryptophyl-D-tryptophane [French] [ACD/IUPAC Name]
141594-26-5 [RN]
D-Tryptophan, N-(N-(N-((hexahydro-1H-azepin-1-yl)carbonyl)-L-leucyl)-D-tryptophyl)-
N-(N-(N-((Hexahydro-1H-azepin-1-yl)carbonyl)-L-leucyl)-D-tryptophyl)-D-tryptophan
Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan
Perhydroazepin-1-yl-leu-trp-trp

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

BQ 485 [DBID]
BQ-485 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1023.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 156.6±3.0 kJ/mol
Flash Point: 572.8±34.3 °C
Index of Refraction: 1.641
Molar Refractivity: 177.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 4
ACD/LogP: 5.97
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 6.55
ACD/KOC (pH 5.5): 33.92
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.17
Polar Surface Area: 159 Å2
Polarizability: 70.2±0.5 10-24cm3
Surface Tension: 62.8±3.0 dyne/cm
Molar Volume: 491.2±3.0 cm3

Click to predict properties on the Chemicalize site


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