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Search term: FKMTZJPWARGCCN-OAHLLOKOSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-{2'-[(6S)-6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-6-yl]-3-biphenylyl}methanesulfonamide | C19H19N3O2S

N-{2'-[(6S)-6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-6-yl]-3-biphenylyl}methanesulfonamide

  • Molecular FormulaC19H19N3O2S
  • Average mass353.438 Da
  • Monoisotopic mass353.119812 Da
  • ChemSpider ID24716316

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Methanesulfonamide, N-[2'-[(6S)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-6-yl][1,1'-biphenyl]-3-yl]- [ACD/Index Name]
N-{2'-[(6S)-6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-6-yl]-3-biphenylyl}methanesulfonamide [ACD/IUPAC Name]
N-{2'-[(6S)-6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-6-yl]-3-biphénylyl}méthanesulfonamide [French] [ACD/IUPAC Name]
N-{2'-[(6S)-6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-6-yl]-3-biphenylyl}methansulfonamid [German] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL513871/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 593.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 313.0±32.9 °C
Index of Refraction: 1.678
Molar Refractivity: 99.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.71
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 28.15
ACD/KOC (pH 7.4): 304.41
Polar Surface Area: 72 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 54.1±7.0 dyne/cm
Molar Volume: 264.0±7.0 cm3

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