Found 30 results

Search term: MF = 'C_{29}H_{47}N_{5}O_{8}'
ChemSpider 2D Image | N~2~-(2,5-Dihydroxybenzoyl)-L-lysyl-N-{6-[(1-carboxypropyl)amino]-6-oxohexyl}-L-isoleucinamide | C29H47N5O8

N2-(2,5-Dihydroxybenzoyl)-L-lysyl-N-{6-[(1-carboxypropyl)amino]-6-oxohexyl}-L-isoleucinamide

  • Molecular FormulaC29H47N5O8
  • Average mass593.712 Da
  • Monoisotopic mass593.342468 Da
  • ChemSpider ID23140534

  • defined stereocentres - 2 of 4 defined stereocentres

More details:

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

L-Isoleucinamide, N2-(2,5-dihydroxybenzoyl)-L-lysyl-N-[6-[(1-carboxypropyl)amino]-6-oxohexyl]- [ACD/Index Name]
N2-(2,5-Dihydroxybenzoyl)-L-lysyl-N-{6-[(1-carboxypropyl)amino]-6-oxohexyl}-L-isoleucinamid [German] [ACD/IUPAC Name]
N2-(2,5-Dihydroxybenzoyl)-L-lysyl-N-{6-[(1-carboxypropyl)amino]-6-oxohexyl}-L-isoleucinamide [ACD/IUPAC Name]
N2-(2,5-Dihydroxybenzoyl)-L-lysyl-N-{6-[(1-carboxypropyl)amino]-6-oxohexyl}-L-isoleucinamide [French] [ACD/IUPAC Name]
2-{6-[(2S)-2-[(2S)-6-amino-2-[(2,5-dihydroxyphenyl)formamido]hexanamido]-3-methylpentanamido]hexanamido}butanoic acid
CHEMBL45061
Nazumamide A (NAZA) analogue

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

Density: 1.2±0.1 g/cm3
Boiling Point: 947.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 144.5±3.0 kJ/mol
Flash Point: 526.8±34.3 °C
Index of Refraction: 1.551
Molar Refractivity: 156.7±0.3 cm3
#H bond acceptors: 13
#H bond donors: 9
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 3
ACD/LogP: 1.80
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 220 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 490.9±3.0 cm3

Click to predict properties on the Chemicalize site


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