ChemSpider 2D Image | (2S,3S,4R,5R)-5-(4-[(2,2-Diphenylethyl)amino]-6-{1-[(propylsulfonyl)amino]ethyl}-1H-benzimidazol-1-yl)-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamide | C33H41N5O6S

(2S,3S,4R,5R)-5-(4-[(2,2-Diphenylethyl)amino]-6-{1-[(propylsulfonyl)amino]ethyl}-1H-benzimidazol-1-yl)-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamide

  • Molecular FormulaC33H41N5O6S
  • Average mass635.773 Da
  • Monoisotopic mass635.277771 Da
  • ChemSpider ID7985261

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(2S,3S,4R,5R)-5-(4-[(2,2-Diphenylethyl)amino]-6-{1-[(propylsulfonyl)amino]ethyl}-1H-benzimidazol-1-yl)-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamid [German] [ACD/IUPAC Name]
(2S,3S,4R,5R)-5-(4-[(2,2-Diphenylethyl)amino]-6-{1-[(propylsulfonyl)amino]ethyl}-1H-benzimidazol-1-yl)-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamide [ACD/IUPAC Name]
(2S,3S,4R,5R)-5-(4-[(2,2-Diphényléthyl)amino]-6-{1-[(propylsulfonyl)amino]éthyl}-1H-benzimidazol-1-yl)-N-éthyl-3,4-dihydroxytétrahydro-2-furanecarboxamide [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: 1.656
Molar Refractivity: 171.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 117.97
ACD/KOC (pH 5.5): 1050.22
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 120.91
ACD/KOC (pH 7.4): 1076.43
Polar Surface Area: 163 Å2
Polarizability: 67.9±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 465.7±7.0 cm3

Click to predict properties on the Chemicalize site


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