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Search term: BMIKOSBWXPCSLE-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-{[5-({2-[4-(Carboxymethyl)-1-piperidinyl]benzyl}sulfamoyl)-2,4-dimethoxyphenyl]amino}-4-oxobutanoic acid | C26H33N3O9S

4-{[5-({2-[4-(Carboxymethyl)-1-piperidinyl]benzyl}sulfamoyl)-2,4-dimethoxyphenyl]amino}-4-oxobutanoic acid

  • Molecular FormulaC26H33N3O9S
  • Average mass563.620 Da
  • Monoisotopic mass563.193726 Da
  • ChemSpider ID28495494

More details:

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

4-{[5-({2-[4-(Carboxymethyl)-1-piperidinyl]benzyl}sulfamoyl)-2,4-dimethoxyphenyl]amino}-4-oxobutanoic acid [ACD/IUPAC Name]
4-{[5-({2-[4-(Carboxymethyl)-1-piperidinyl]benzyl}sulfamoyl)-2,4-dimethoxyphenyl]amino}-4-oxobutansäure [German] [ACD/IUPAC Name]
4-Piperidineacetic acid, 1-[2-[[[[5-[(3-carboxy-1-oxopropyl)amino]-2,4-dimethoxyphenyl]sulfonyl]amino]methyl]phenyl]- [ACD/Index Name]
Acide 4-{[5-({2-[4-(carboxyméthyl)-1-pipéridinyl]benzyl}sulfamoyl)-2,4-diméthoxyphényl]amino}-4-oxobutanoïque [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: 1.597
Molar Refractivity: 141.1±0.4 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 1.47
ACD/LogD (pH 5.5): -0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 180 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 413.9±3.0 cm3

Click to predict properties on the Chemicalize site


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