ChemSpider 2D Image | Ethyl 2-({4-[butyl(methyl)sulfamoyl]benzoyl}amino)-3-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate | C28H35N5O6S2

Ethyl 2-({4-[butyl(methyl)sulfamoyl]benzoyl}amino)-3-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate

  • Molecular FormulaC28H35N5O6S2
  • Average mass601.737 Da
  • Monoisotopic mass601.202881 Da
  • ChemSpider ID2524815

More details:

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

2-({4-[Butyl(méthyl)sulfamoyl]benzoyl}amino)-3-[(3,5-diméthyl-1H-pyrazol-1-yl)carbonyl]-4,7-dihydrothiéno[2,3-c]pyridine-6(5H)-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 2-({4-[butyl(methyl)sulfamoyl]benzoyl}amino)-3-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate [ACD/IUPAC Name]
Ethyl-2-({4-[butyl(methyl)sulfamoyl]benzoyl}amino)-3-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-4,7-dihydrothieno[2,3-c]pyridin-6(5H)-carboxylat [German] [ACD/IUPAC Name]
Thieno[2,3-c]pyridine-6(5H)-carboxylic acid, 2-[[4-[(butylmethylamino)sulfonyl]benzoyl]amino]-3-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-4,7-dihydro-, ethyl ester [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: 1.649
Molar Refractivity: 160.0±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 6.12
ACD/LogD (pH 5.5): 5.26
ACD/BCF (pH 5.5): 5810.71
ACD/KOC (pH 5.5): 17219.75
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5810.31
ACD/KOC (pH 7.4): 17218.59
Polar Surface Area: 168 Å2
Polarizability: 63.4±0.5 10-24cm3
Surface Tension: 53.5±7.0 dyne/cm
Molar Volume: 439.0±7.0 cm3

Click to predict properties on the Chemicalize site


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