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Search term: XMHHXGQAUPXIKY-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 4'-Fluoro-4,5-dihydroxy-N-[4-(thieno[2,3-c]pyridin-2-yl)butyl]-3-biphenylcarboxamide | C24H21FN2O3S

4'-Fluoro-4,5-dihydroxy-N-[4-(thieno[2,3-c]pyridin-2-yl)butyl]-3-biphenylcarboxamide

  • Molecular FormulaC24H21FN2O3S
  • Average mass436.499 Da
  • Monoisotopic mass436.125702 Da
  • ChemSpider ID61716385

More details:






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

[1,1'-Biphenyl]-3-carboxamide, 4'-fluoro-4,5-dihydroxy-N-(4-thieno[2,3-c]pyridin-2-ylbutyl)- [ACD/Index Name]
4'-Fluor-4,5-dihydroxy-N-[4-(thieno[2,3-c]pyridin-2-yl)butyl]-3-biphenylcarboxamid [German] [ACD/IUPAC Name]
4'-Fluoro-4,5-dihydroxy-N-[4-(thieno[2,3-c]pyridin-2-yl)butyl]-3-biphenylcarboxamide [ACD/IUPAC Name]
4'-Fluoro-4,5-dihydroxy-N-[4-(thiéno[2,3-c]pyridin-2-yl)butyl]-3-biphénylcarboxamide [French] [ACD/IUPAC Name]
5-(4-Fluorophenyl)-2,3-Dihydroxy-N-(4-Thieno[2,3-C]pyridin-2-Ylbutyl)benzamide
76G

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

Density: 1.4±0.1 g/cm3
Boiling Point: 648.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.1±3.0 kJ/mol
Flash Point: 346.0±31.5 °C
Index of Refraction: 1.671
Molar Refractivity: 120.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.23
ACD/LogD (pH 5.5): 4.57
ACD/BCF (pH 5.5): 1623.85
ACD/KOC (pH 5.5): 6260.93
ACD/LogD (pH 7.4): 4.59
ACD/BCF (pH 7.4): 1660.20
ACD/KOC (pH 7.4): 6401.08
Polar Surface Area: 111 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 323.2±3.0 cm3

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