ChemSpider 2D Image | 3-{3-[(4-Azidophenyl)sulfonyl]-1-(4-hydroxy-3-iodobenzyl)-5-isopropyl-1H-indol-2-yl}-2,2-dimethylpropanoic acid | C29H29IN4O5S

3-{3-[(4-Azidophenyl)sulfonyl]-1-(4-hydroxy-3-iodobenzyl)-5-isopropyl-1H-indol-2-yl}-2,2-dimethylpropanoic acid

  • Molecular FormulaC29H29IN4O5S
  • Average mass672.534 Da
  • Monoisotopic mass672.090332 Da
  • ChemSpider ID115935

More details:

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

1H-Indole-2-propanoic acid, 3-[(4-azidophenyl)sulfonyl]-1-[(4-hydroxy-3-iodophenyl)methyl]-α,α-dimethyl-5-(1-methylethyl)- [ACD/Index Name]
3-{3-[(4-Azidophenyl)sulfonyl]-1-(4-hydroxy-3-iodbenzyl)-5-isopropyl-1H-indol-2-yl}-2,2-dimethylpropansäure [German] [ACD/IUPAC Name]
3-{3-[(4-Azidophenyl)sulfonyl]-1-(4-hydroxy-3-iodobenzyl)-5-isopropyl-1H-indol-2-yl}-2,2-dimethylpropanoic acid [ACD/IUPAC Name]
Acide 3-{3-[(4-azidophényl)sulfonyl]-1-(4-hydroxy-3-iodobenzyl)-5-isopropyl-1H-indol-2-yl}-2,2-diméthylpropanoïque [French] [ACD/IUPAC Name]
130007-52-2 [RN]
1H-Indole-2-propanoic acid, 3-((4-azidophenyl)sulfonyl)-1-((4-hydroxy-3-iodophenyl)methyl)-α,α-dimethyl-5-(1-methylethyl)-
3-[3-(4-Azidophenyl)sulfonyl-1-[(4-hydroxy-3-iodophenyl)methyl]-5-propan-2-ylindol-2-yl]-2,2-dimethylpropanoic acid

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

L 669083 [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.35
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 9203.84
ACD/KOC (pH 5.5): 12609.25
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 134.22
ACD/KOC (pH 7.4): 183.89
Polar Surface Area: 117 Å2
Polarizability:
Surface Tension:
Molar Volume:

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