ChemSpider 2D Image | 1,2,5,6-Tetradeoxy-2,5-bis{[2-(glycoloylamino)benzoyl]amino}-1,6-diphenyl-L-altritol | C36H38N4O8

1,2,5,6-Tetradeoxy-2,5-bis{[2-(glycoloylamino)benzoyl]amino}-1,6-diphenyl-L-altritol

  • Molecular FormulaC36H38N4O8
  • Average mass654.709 Da
  • Monoisotopic mass654.268982 Da
  • ChemSpider ID411552

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,2,5,6-tetradeoxy-2,5-bis({2-[(hydroxyacetyl)amino]benzoyl}amino)-1,6-diphenyl-L-altritol
1,2,5,6-Tetradeoxy-2,5-bis{[2-(glycoloylamino)benzoyl]amino}-1,6-diphenyl-L-altritol [ACD/IUPAC Name]
1,2,5,6-Tétradésoxy-2,5-bis({2-[(2-hydroxyacétyl)amino]benzoyl}amino)-1,6-diphényl-L-altritol [French] [ACD/IUPAC Name]
1,2,5,6-Tetradesoxy-2,5-bis{[2-(glycoloylamino)benzoyl]amino}-1,6-diphenyl-L-altritol [German] [ACD/IUPAC Name]
L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis[[2-[(2-hydroxyacetyl)amino]benzoyl]amino]-1,6-diphenyl- [ACD/Index Name]
173094-23-0 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL314408/
L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis((2-((hydroxyacetyl)amino)benzoyl)amino)-1,6-diphenyl-
L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis[[2-[(hydroxyacetyl)amino]benzoyl]amino]-1,6-diphenyl-
N-[(2S,3R,4S,5S)-3,4-dihydroxy-5-{[2-(2-hydroxyacetamido)phenyl]formamido}-1,6-diphenylhexan-2-yl]-2-(2-hydroxyacetamido)benzamide
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AIDS058323 [DBID]
AIDS-058323 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1120.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 172.8±3.0 kJ/mol
Flash Point: 631.6±34.3 °C
Index of Refraction: 1.679
Molar Refractivity: 179.7±0.3 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 119.48
ACD/KOC (pH 5.5): 1067.21
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 119.48
ACD/KOC (pH 7.4): 1067.21
Polar Surface Area: 197 Å2
Polarizability: 71.2±0.5 10-24cm3
Surface Tension: 69.8±3.0 dyne/cm
Molar Volume: 476.1±3.0 cm3

Click to predict properties on the Chemicalize site


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