11-(2,6-difluoro-3,5-dimethoxyphenyl)-13-ethyl-4-(morpholin-4-ylmethyl)-5,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1,3,6,8-tetraen-12-one

  • Description:
  • Formula: C24H27F2N5O4
  • Molar mass: 487.5 g mol-1
  • InChI Key: HCDMJFOHIXMBOV-UHFFFAOYSA-N
11-(2,6-difluoro-3,5-dimethoxyphenyl)-13-ethyl-4-(morpholin-4-ylmethyl)-5,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1,3,6,8-tetraen-12-one

Identifiers (10)

  • Standard InChI: InChI=1S/C24H27F2N5O4/c1-4-30-21-14(11-27-23-16(21)9-15(28-23)13-29-5-7-35-8-6-29)12-31(24(30)32)22-19(25)17(33-2)10-18(34-3)20(22)26/h9-11H,4-8,12-13H2,1-3H3,(H,27,28) (Source: PubChem)
  • IUPAC Name: 11-(2,6-difluoro-3,5-dimethoxyphenyl)-13-ethyl-4-(morpholin-4-ylmethyl)-5,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1,3,6,8-tetraen-12-one (Source: PubChem)
  • PubChem CID: 86705695 (Source: PubChem)
  • SMILES String: CCN1C2=C3C=C(NC3=NC=C2CN(C1=O)C4=C(C(=CC(=C4F)OC)OC)F)CN5CCOCC5 (Source: PubChem)
  • Connectivity SMILES string: CCN1C2=C3C=C(NC3=NC=C2CN(C1=O)C4=C(C(=CC(=C4F)OC)OC)F)CN5CCOCC5 (Source: PubChem)
  • Standard InChIKey: HCDMJFOHIXMBOV-UHFFFAOYSA-N (Source: PubChem)
  • CAS Registry Number: 1513857-77-6 (Source: PubChem)
  • ChEMBL ID: CHEMBL4297522 (Source: PubChem)
  • CompTox Dashboard Compound ID: DTXCID401513523 (Source: PubChem)
  • CompTox Dashboard Substance ID: DTXSID501027955 (Source: PubChem)

    • Sources: PubChem (10)

    Data (29)

  • Mass parameters: 487.20311068 (Source: PubChem)
  • Surface parameters: 83.2 (Source: PubChem)
  • Thermodynamic parameters: 1.8 (Source: PubChem)
  • Molecule statistics: 1 (Source: PubChem)
  • Molecule statistics: 8 (Source: PubChem)
  • Surface parameters: 35 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Molecule statistics: 6 (Source: PubChem)
  • Stuctural analysis: 731 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Thermodynamic parameters: 1.8 (Source: PubChem)
  • Molecule statistics: 1 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Mass parameters: 487.20311068 Da (Source: PubChem)
  • Molecule statistics: 35 (Source: PubChem)
  • Molecule statistics: 8 (Source: PubChem)
  • Molecule statistics: 1 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Surface parameters: 0 (Source: PubChem)
  • Stuctural analysis: 731 (Source: PubChem)
  • Stuctural analysis: 358.6 (Source: PubChem)
  • Mass parameters: 487.5 g/mol (Source: PubChem)
  • Mass parameters: 487.20311068 Da (Source: PubChem)
  • Molecule statistics: 6 (Source: PubChem)
  • Surface parameters: 83.2 Ų (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)
  • Molecule statistics: 0 (Source: PubChem)

    • Sources: PubChem (29)

    Information (1)

  • Chemical formula: C24H27F2N5O4 (Source: PubChem)

    • Sources: PubChem (1)