N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

  • Description:
  • Formula: C22H27FN4O2
  • Molar mass: 398.5 g mol-1
  • InChI Key: WINHZLLDWRZWRT-ATVHPVEESA-N
N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

Identifiers (11)

  • Standard InChI: InChI=1S/C22H27FN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12- (Source: PubChem)
  • IUPAC Name: N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide (Source: PubChem)
  • PubChem CID: 5329102 (Source: PubChem)
  • CAS Registry Number: 557795-19-4 (Source: PubChem)
  • Connectivity SMILES string: CCN(CC)CCNC(=O)C1=C(NC(=C1C)C=C2C3=C(C=CC(=C3)F)NC2=O)C (Source: PubChem)
  • SMILES String: CCN(CC)CCNC(=O)C1=C(NC(=C1C)/C=C\2/C3=C(C=CC(=C3)F)NC2=O)C (Source: PubChem)
  • Standard InChIKey: WINHZLLDWRZWRT-ATVHPVEESA-N (Source: PubChem)
  • ChEMBL ID: CHEMBL535 (Source: PubChem)
  • CompTox Dashboard Compound ID: DTXCID9021134 (Source: PubChem)
  • CompTox Dashboard Substance ID: DTXSID1041134 (Source: PubChem)
  • European Community Number: 111-194-2 (Source: PubChem)

    • Sources: PubChem (11)

    Data (28)

  • Thermodynamic parameters: 2.6 (Source: PubChem)
  • Surface parameters: 29 (Source: PubChem)
  • Molecule statistics: 4 (Source: PubChem)
  • Molecule statistics: 3 (Source: PubChem)
  • Stuctural analysis: 636 (Source: PubChem)
  • Molecule statistics: 7 (Source: PubChem)
  • Surface parameters: 77.2 (Source: PubChem)
  • Molecule statistics: 1 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Molecule statistics: 1 (Source: PubChem)
  • Thermodynamic parameters: 2.6 (Source: PubChem)
  • Molecule statistics: 1 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Molecule statistics: 1 (Source: PubChem)
  • Mass parameters: 398.21180428 Da (Source: PubChem)
  • Molecule statistics: 29 (Source: PubChem)
  • Molecule statistics: 4 (Source: PubChem)
  • Molecule statistics: 3 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Surface parameters: 0 (Source: PubChem)
  • Stuctural analysis: 636 (Source: PubChem)
  • Stuctural analysis: 314.6 (Source: PubChem)
  • Mass parameters: 398.5 g/mol (Source: PubChem)
  • Mass parameters: 398.21180428 Da (Source: PubChem)
  • Molecule statistics: 7 (Source: PubChem)
  • Surface parameters: 77.2 Ų (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)

    • Sources: PubChem (28)

    Information (1)

  • Chemical formula: C22H27FN4O2 (Source: PubChem)

    • Sources: PubChem (1)