Cas no 21240-67-5 (3,5,11-trimethyl-6H-pyrido[4,3-b]carbazole)

3,5,11-trimethyl-6H-pyrido[4,3-b]carbazole structure
21240-67-5 structure
Product Name:3,5,11-trimethyl-6H-pyrido[4,3-b]carbazole
CAS No:21240-67-5
MF:C18H16N2
MW:260.333044052124
CID:911353
PubChem ID:265962
Update Time:2025-04-19

3,5,11-trimethyl-6H-pyrido[4,3-b]carbazole Chemical and Physical Properties

Names and Identifiers

    • 3,5,11-trimethyl-6H-pyrido[4,3-b]carbazole
    • 3-Methylellipticine
    • Ellipticine, 3-methyl-
    • 21240-67-5
    • NSC102822
    • DTXSID70418936
    • NSC-102822
    • Inchi: 1S/C18H16N2/c1-10-8-14-12(3)18-17(11(2)15(14)9-19-10)13-6-4-5-7-16(13)20-18/h4-9,19H,1-3H3
    • InChI Key: POHNGXKQUDYAHX-UHFFFAOYSA-N
    • SMILES: N1C2C=CC=CC=2C2C=1C(C)=C1C=C(C)NC=C1C=2C

Computed Properties

  • Exact Mass: 260.13148
  • Monoisotopic Mass: 260.131348519g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 0
  • Complexity: 640
  • 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: 4.1
  • Topological Polar Surface Area: 24.4?2

Experimental Properties

  • PSA: 28.68
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