Found 23 results

Search term: MF = 'C_{21}H_{24}N_{2}O_{9}S_{2}'
ChemSpider 2D Image | Ethyl 4-[(methoxycarbonyl)carbamoyl]-5-({3-[(4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-methyl-2-thiophenecarboxylate | C21H24N2O9S2

Ethyl 4-[(methoxycarbonyl)carbamoyl]-5-({3-[(4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-methyl-2-thiophenecarboxylate

  • Molecular FormulaC21H24N2O9S2
  • Average mass512.553 Da
  • Monoisotopic mass512.092346 Da
  • ChemSpider ID21067686

More details:

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

2-Thiophenecarboxylic acid, 4-[[(methoxycarbonyl)amino]carbonyl]-5-[[3-[(4-methoxyphenyl)sulfonyl]-1-oxopropyl]amino]-3-methyl-, ethyl ester [ACD/Index Name]
4-[(Méthoxycarbonyl)carbamoyl]-5-({3-[(4-méthoxyphényl)sulfonyl]propanoyl}amino)-3-méthyl-2-thiophènecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-[(methoxycarbonyl)carbamoyl]-5-({3-[(4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-methyl-2-thiophenecarboxylate [ACD/IUPAC Name]
Ethyl-4-[(methoxycarbonyl)carbamoyl]-5-({3-[(4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-methyl-2-thiophencarboxylat [German] [ACD/IUPAC Name]
ethyl 4-((methoxycarbonyl)carbamoyl)-5-(3-((4-methoxyphenyl)sulfonyl)propanamido)-3-methylthiophene-2-carboxylate

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: 1.576
Molar Refractivity: 122.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.32
ACD/KOC (pH 5.5): 782.03
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.09
ACD/KOC (pH 7.4): 779.74
Polar Surface Area: 191 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 56.6±3.0 dyne/cm
Molar Volume: 369.7±3.0 cm3

Click to predict properties on the Chemicalize site


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