ChemSpider 2D Image | N~5~-(Diaminomethylene)-L-ornithyl-N-(5-{[N~2~-(1H-indol-3-ylacetyl)-L-asparaginyl]amino}pentyl)-L-ornithinamide | C30H49N11O5

N5-(Diaminomethylene)-L-ornithyl-N-(5-{[N2-(1H-indol-3-ylacetyl)-L-asparaginyl]amino}pentyl)-L-ornithinamide

  • Molecular FormulaC30H49N11O5
  • Average mass643.781 Da
  • Monoisotopic mass643.391785 Da
  • ChemSpider ID9942117

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Ornithinamide, N5-(diaminomethylene)-L-ornithyl-N-[5-[[(2S)-4-amino-2-[[2-(1H-indol-3-yl)acetyl]amino]-1,4-dioxobutyl]amino]pentyl]- [ACD/Index Name]
N5-(Diaminomethylen)-L-ornithyl-N-(5-{[N2-(1H-indol-3-ylacetyl)-L-asparaginyl]amino}pentyl)-L-ornithinamid [German] [ACD/IUPAC Name]
N5-(Diaminomethylene)-L-ornithyl-N-(5-{[N2-(1H-indol-3-ylacetyl)-L-asparaginyl]amino}pentyl)-L-ornithinamide [ACD/IUPAC Name]
N5-(Diaminométhylène)-L-ornithyl-N-[5-({N2-[2-(1H-indol-3-yl)acétyl]-L-asparaginyl}amino)pentyl]-L-ornithinamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.658
Molar Refractivity: 167.9±0.5 cm3
#H bond acceptors: 16
#H bond donors: 15
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 3
ACD/LogP: -1.76
ACD/LogD (pH 5.5): -6.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 292 Å2
Polarizability: 66.6±0.5 10-24cm3
Surface Tension: 63.3±7.0 dyne/cm
Molar Volume: 455.9±7.0 cm3

Click to predict properties on the Chemicalize site


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