Cas no 208345-46-4 (Methanone, [oxybis(6-amino-3,1-phenylene)]bis[(4-methoxyphenyl)-)

Methanone, [oxybis(6-amino-3,1-phenylene)]bis[(4-methoxyphenyl)- structure
208345-46-4 structure
Product Name:Methanone, [oxybis(6-amino-3,1-phenylene)]bis[(4-methoxyphenyl)-
CAS No:208345-46-4
MF:C28H24N2O5
MW:468.500567436218
CID:1396556
PubChem ID:71358409
Update Time:2025-04-20

Methanone, [oxybis(6-amino-3,1-phenylene)]bis[(4-methoxyphenyl)- Chemical and Physical Properties

Names and Identifiers

    • Methanone, [oxybis(6-amino-3,1-phenylene)]bis[(4-methoxyphenyl)-
    • [2-amino-5-[4-amino-3-(4-methoxybenzoyl)phenoxy]phenyl]-(4-methoxyphenyl)methanone
    • DTXSID20782417
    • [Oxybis(6-amino-3,1-phenylene)]bis[(4-methoxyphenyl)methanone]
    • 208345-46-4
    • Inchi: 1S/C28H24N2O5/c1-33-19-7-3-17(4-8-19)27(31)23-15-21(11-13-25(23)29)35-22-12-14-26(30)24(16-22)28(32)18-5-9-20(34-2)10-6-18/h3-16H,29-30H2,1-2H3
    • InChI Key: QEYJFAWAYCEENE-UHFFFAOYSA-N
    • SMILES: O(C1=CC=C(C(C(C2C=CC(=CC=2)OC)=O)=C1)N)C1=CC=C(C(C(C2C=CC(=CC=2)OC)=O)=C1)N

Computed Properties

  • Exact Mass: 468.16862
  • Monoisotopic Mass: 468.16852187g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 35
  • Rotatable Bond Count: 8
  • Complexity: 644
  • 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: 5.8
  • Topological Polar Surface Area: 114?2

Experimental Properties

  • PSA: 113.87
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