Found 99 results

Search term: MF = 'C_{23}H_{32}N_{2}O_{8}S'
ChemSpider 2D Image | 2-{[(1S,2R,3R)-2,3-Dimethylcyclohexyl]amino}-2-oxoethyl (4R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-hydroxy-L-prolinate | C23H32N2O8S

2-{[(1S,2R,3R)-2,3-Dimethylcyclohexyl]amino}-2-oxoethyl (4R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-hydroxy-L-prolinate

  • Molecular FormulaC23H32N2O8S
  • Average mass496.574 Da
  • Monoisotopic mass496.187927 Da
  • ChemSpider ID62430186

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(4R)-1-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-hydroxy-L-prolinate de 2-{[(1S,2R,3R)-2,3-diméthylcyclohexyl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-{[(1S,2R,3R)-2,3-Dimethylcyclohexyl]amino}-2-oxoethyl (4R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-hydroxy-L-prolinate [ACD/IUPAC Name]
2-{[(1S,2R,3R)-2,3-Dimethylcyclohexyl]amino}-2-oxoethyl-(4R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-hydroxy-L-prolinat [German] [ACD/IUPAC Name]
L-Proline, 1-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]-4-hydroxy-, 2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl ester, (4R)- [ACD/Index 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: 1.605
Molar Refractivity: 122.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 117.45
ACD/KOC (pH 5.5): 1054.90
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 117.45
ACD/KOC (pH 7.4): 1054.89
Polar Surface Area: 140 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 63.8±5.0 dyne/cm
Molar Volume: 355.7±5.0 cm3

Click to predict properties on the Chemicalize site


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