Cas no 65426-89-3 (2-[4-(4-carbamimidoylphenoxy)phenyl]-1H-indole-6-carboximidamide)

2-[4-(4-carbamimidoylphenoxy)phenyl]-1H-indole-6-carboximidamide structure
65426-89-3 structure
Product Name:2-[4-(4-carbamimidoylphenoxy)phenyl]-1H-indole-6-carboximidamide
CAS No:65426-89-3
MF:C22H19N5O
MW:369.419163942337
CID:1687086
PubChem ID:47626
Update Time:2025-04-21

2-[4-(4-carbamimidoylphenoxy)phenyl]-1H-indole-6-carboximidamide Chemical and Physical Properties

Names and Identifiers

    • 2-[4-(4-carbamimidoylphenoxy)phenyl]-1H-indole-6-carboximidamide
    • 1H-indole-6-carboximidamide, 2-[4-[4-(aminoiminomethyl)phenoxy]phenyl]-
    • SCHEMBL2847677
    • 2-(4-(4-(Aminoiminomethyl)phenoxy)phenyl)-1H-indole-6-carboximidamide
    • BDBM50100895
    • 2-[4-(4-carbamimidoylphenoxy)phenyl]-1H-indole-6-carboxamidine
    • 5CZ
    • 2-[4-(4-Carbamimidoyl-phenoxy)-phenyl]-1H-indole-6-carboxamidine
    • DTXSID70215745
    • Q27455650
    • BRN 0450636
    • 65426-89-3
    • 2-(4-(4-carbamimidoylphenoxy)phenyl)-1H-indole-6-carboximidamide
    • C-{2-[4-(4-Diaminomethyl-phenoxy)-phenyl]-1H-indol-6-yl}-methanediamine
    • RWJ-61907
    • NSC-240898
    • CHEMBL598230
    • 1H-INDOLE-6-CARBOXIMIDAMIDE, 2-(4-(4-(AMINOIMINOMETHYL)PHENOXY)PHENYL)-
    • CHEMBL289577
    • Inchi: 1S/C22H19N5O/c23-21(24)14-5-9-18(10-6-14)28-17-7-3-13(4-8-17)19-11-15-1-2-16(22(25)26)12-20(15)27-19/h1-12,27H,(H3,23,24)(H3,25,26)
    • InChI Key: OSSYTOVYXCAWPG-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C(=N)N)=CC=1)C1C=CC(=CC=1)C1=CC2C=CC(C(=N)N)=CC=2N1

Computed Properties

  • Exact Mass: 369.15896025g/mol
  • Monoisotopic Mass: 369.15896025g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 5
  • Complexity: 565
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 125?2
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