ChemSpider 2D Image | 3-Cyclopentyl 6-vinyl 2-[(2-thienylacetyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate | C22H24N2O5S2

3-Cyclopentyl 6-vinyl 2-[(2-thienylacetyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate

  • Molecular FormulaC22H24N2O5S2
  • Average mass460.566 Da
  • Monoisotopic mass460.112671 Da
  • ChemSpider ID26327047

More details:

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

2-{[2-(2-Thiényl)acétyl]amino}-4,7-dihydrothiéno[2,3-c]pyridine-3,6(5H)-dicarboxylate de 3-cyclopentyle et de 6-vinyle [French] [ACD/IUPAC Name]
3-Cyclopentyl 6-Ethenyl 2-[(Thiophen-2-Ylacetyl)amino]-4,7-Dihydrothieno[2,3-C]pyridine-3,6(5h)-Dicarboxylate
3-Cyclopentyl 6-vinyl 2-[(2-thienylacetyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate [ACD/IUPAC Name]
3-Cyclopentyl-6-vinyl-2-[(2-thienylacetyl)amino]-4,7-dihydrothieno[2,3-c]pyridin-3,6(5H)-dicarboxylat [German] [ACD/IUPAC Name]
Thieno[2,3-c]pyridine-3,6(5H)-dicarboxylic acid, 4,7-dihydro-2-[[2-(2-thienyl)acetyl]amino]-, 3-cyclopentyl 6-ethenyl 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: 701.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.7±3.0 kJ/mol
Flash Point: 378.3±32.9 °C
Index of Refraction: 1.639
Molar Refractivity: 119.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.05
ACD/LogD (pH 5.5): 4.27
ACD/BCF (pH 5.5): 1037.17
ACD/KOC (pH 5.5): 5015.84
ACD/LogD (pH 7.4): 4.27
ACD/BCF (pH 7.4): 1037.16
ACD/KOC (pH 7.4): 5015.83
Polar Surface Area: 141 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 64.4±5.0 dyne/cm
Molar Volume: 332.4±5.0 cm3

Click to predict properties on the Chemicalize site


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