ChemSpider 2D Image | Nalpha-Acetyl-2,3-dimethoxy-N-(1-{[4-(2-methyl-2-propanyl)phenyl]sulfonyl}-4-piperidinyl)phenylalaninamide | C28H39N3O6S

Nα-Acetyl-2,3-dimethoxy-N-(1-{[4-(2-methyl-2-propanyl)phenyl]sulfonyl}-4-piperidinyl)phenylalaninamide

  • Molecular FormulaC28H39N3O6S
  • Average mass545.691 Da
  • Monoisotopic mass545.255981 Da
  • ChemSpider ID2482864

More details:

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

Benzenepropanamide, α-(acetylamino)-N-[1-[[4-(1,1-dimethylethyl)phenyl]sulfonyl]-4-piperidinyl]-2,3-dimethoxy- [ACD/Index Name]
Nα-Acetyl-2,3-dimethoxy-N-(1-{[4-(2-methyl-2-propanyl)phenyl]sulfonyl}-4-piperidinyl)phenylalaninamid [German] [ACD/IUPAC Name]
Nα-Acetyl-2,3-dimethoxy-N-(1-{[4-(2-methyl-2-propanyl)phenyl]sulfonyl}-4-piperidinyl)phenylalaninamide [ACD/IUPAC Name]
Nα-Acétyl-2,3-diméthoxy-N-(1-{[4-(2-méthyl-2-propanyl)phényl]sulfonyl}-4-pipéridinyl)phénylalaninamide [French] [ACD/IUPAC Name]

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

ASN 10231859 [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: 1.587
Molar Refractivity: 147.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.86
ACD/LogD (pH 5.5): 3.59
ACD/BCF (pH 5.5): 313.20
ACD/KOC (pH 5.5): 2128.70
ACD/LogD (pH 7.4): 3.59
ACD/BCF (pH 7.4): 313.20
ACD/KOC (pH 7.4): 2128.70
Polar Surface Area: 122 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 54.4±5.0 dyne/cm
Molar Volume: 437.9±5.0 cm3

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