ChemSpider 2D Image | Satavaptan | C33H45N3O8S

Satavaptan

  • Molecular FormulaC33H45N3O8S
  • Average mass643.791 Da
  • Monoisotopic mass643.292725 Da
  • ChemSpider ID32699105
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

185913-78-4 [RN]
4-{[(1s,4s)-5'-Ethoxy-4-[2-(4-morpholinyl)ethoxy]-2'-oxospiro[cyclohexane-1,3'-indol]-1'(2'H)-yl]sulfonyl}-3-methoxy-N-(2-methyl-2-propanyl)benzamid [German] [ACD/IUPAC Name]
4-{[(1s,4s)-5'-Ethoxy-4-[2-(4-morpholinyl)ethoxy]-2'-oxospiro[cyclohexane-1,3'-indol]-1'(2'H)-yl]sulfonyl}-3-methoxy-N-(2-methyl-2-propanyl)benzamide [ACD/IUPAC Name]
4-{[(1s,4s)-5'-Éthoxy-4-[2-(4-morpholinyl)éthoxy]-2'-oxospiro[cyclohexane-1,3'-indol]-1'(2'H)-yl]sulfonyl}-3-méthoxy-N-(2-méthyl-2-propanyl)benzamide [French] [ACD/IUPAC Name]
8591
AJS8S3P31H
Benzamide, N-(1,1-dimethylethyl)-4-[[5'-ethoxy-4-[2-(4-morpholinyl)ethoxy]-2'-oxospiro[cyclohexane-1,3'-[3H]indol]-1'(2'H)-yl]sulfonyl]-3-methoxy- [ACD/Index Name]
Satavaptan [Wiki]
SR 121463A
SR 121463A|SR-121463B|SR-121463F|SR121463A
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.610
Molar Refractivity: 170.0±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 1.76
ACD/BCF (pH 5.5): 6.85
ACD/KOC (pH 5.5): 66.25
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 78.28
ACD/KOC (pH 7.4): 757.30
Polar Surface Area: 132 Å2
Polarizability: 67.4±0.5 10-24cm3
Surface Tension: 60.1±5.0 dyne/cm
Molar Volume: 490.6±5.0 cm3

Click to predict properties on the Chemicalize site





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