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Search term: UWEBUXQKMPHDIG-PMERELPUSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N~2~-(3-Aminobenzyl)-N-[(5S)-6-hydroxy-5-{isobutyl[(4-methylphenyl)sulfonyl]amino}hexyl]-N~2~-phenylglycinamide | C32H44N4O4S

N2-(3-Aminobenzyl)-N-[(5S)-6-hydroxy-5-{isobutyl[(4-methylphenyl)sulfonyl]amino}hexyl]-N2-phenylglycinamide

  • Molecular FormulaC32H44N4O4S
  • Average mass580.781 Da
  • Monoisotopic mass580.308350 Da
  • ChemSpider ID447947

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acetamide, 2-[[(3-aminophenyl)methyl]phenylamino]-N-[(5S)-6-hydroxy-5-[[(4-methylphenyl)sulfonyl](2-methylpropyl)amino]hexyl]- [ACD/Index Name]
N2-(3-aminobenzyl)-N-[(5S)-6-hydroxy-5-{[(4-methylphenyl)sulfonyl](2-methylpropyl)amino}hexyl]-N2-phenylglycinamide
N2-(3-Aminobenzyl)-N-[(5S)-6-hydroxy-5-{isobutyl[(4-methylphenyl)sulfonyl]amino}hexyl]-N2-phenylglycinamid [German] [ACD/IUPAC Name]
N2-(3-Aminobenzyl)-N-[(5S)-6-hydroxy-5-{isobutyl[(4-methylphenyl)sulfonyl]amino}hexyl]-N2-phenylglycinamide [ACD/IUPAC Name]
N2-(3-Aminobenzyl)-N-[(5S)-6-hydroxy-5-{isobutyl[(4-méthylphényl)sulfonyl]amino}hexyl]-N2-phénylglycinamide [French] [ACD/IUPAC Name]
2-[(3-Amino-benzyl)-phenyl-amino]-N-{(S)-6-hydroxy-5-[isobutyl-(toluene-4-sulfonyl)-amino]-hexyl}-acetamide
Lysine Sulfonamide 13n
N2-(3-aminobenzyl)-N1-((5S)-6-hydroxy-5-{isobutyl[(4-methylphenyl)sulfonyl]amino}hexyl)-N2-phenylglycinamide

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

AIDS188995 [DBID]
AIDS-188995 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.601
Molar Refractivity: 166.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 4.68
ACD/BCF (pH 5.5): 2072.15
ACD/KOC (pH 5.5): 8055.63
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2233.75
ACD/KOC (pH 7.4): 8683.84
Polar Surface Area: 124 Å2
Polarizability: 66.0±0.5 10-24cm3
Surface Tension: 54.0±3.0 dyne/cm
Molar Volume: 485.9±3.0 cm3

Click to predict properties on the Chemicalize site


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