ChemSpider 2D Image | N-[2-(4-Carbamimidoylbenzyl)-3-(dimethylamino)-3-oxopropanoyl]-3-(2-naphthyl)-L-alanyl-N~5~-(diaminomethylene)-L-ornithinamide | C32H41N9O4

N-[2-(4-Carbamimidoylbenzyl)-3-(dimethylamino)-3-oxopropanoyl]-3-(2-naphthyl)-L-alanyl-N5-(diaminomethylene)-L-ornithinamide

  • Molecular FormulaC32H41N9O4
  • Average mass615.726 Da
  • Monoisotopic mass615.328125 Da
  • ChemSpider ID8366004

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

L-Ornithinamide, N-[2-[[4-[(Z)-aminoiminomethyl]phenyl]methyl]-3-(dimethylamino)-1,3-dioxopropyl]-3-(2-naphthalenyl)-L-alanyl-N5-(diaminomethylene)- [ACD/Index Name]
N-[2-(4-Carbamimidoylbenzyl)-3-(dimethylamino)-3-oxopropanoyl]-3-(2-naphthyl)-L-alanyl-N5-(diaminomethylen)-L-ornithinamid [German] [ACD/IUPAC Name]
N-[2-(4-Carbamimidoylbenzyl)-3-(dimethylamino)-3-oxopropanoyl]-3-(2-naphthyl)-L-alanyl-N5-(diaminomethylene)-L-ornithinamide [ACD/IUPAC Name]
N-[2-(4-Carbamimidoylbenzyl)-3-(diméthylamino)-3-oxopropanoyl]-3-(2-naphtyl)-L-alanyl-N5-(diaminométhylène)-L-ornithinamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.657
Molar Refractivity: 168.1±0.5 cm3
#H bond acceptors: 13
#H bond donors: 11
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 0.60
ACD/LogD (pH 5.5): -2.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 236 Å2
Polarizability: 66.6±0.5 10-24cm3
Surface Tension: 58.1±7.0 dyne/cm
Molar Volume: 457.2±7.0 cm3

Click to predict properties on the Chemicalize site


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