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Home> Hot Product Listed T   > Thiazolo[5,4-f]quinazoline(9CI)
608515-47-5 structure

Thiazolo[5,4-f]quinazoline(9CI)

Iupac Name:8-fluoroisoquinolin-5-amine
CAS No.:608515-47-5
Molecular Weight:162.167
Molecular Formula:C7H9NO3 (isomer)
Names and Identifiers
Synonyms

[1,3]thiazolo[5,4-f]quinazoline CTK3I6162 DTXSID50663280 PL076268 pyrimidobenzothiazole SCHEMBL3745133 thiazolo[5,4-f]quinazoline (9ci)

Inchi
InChI=1S/C9H7FN2/c10-8-1-2-9(11)6-3-4-12-5-7(6)8/h1-5H,11H2
InChkey
AVQZNGWUZSSPLK-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=C2C=NC=CC2=C1N)F
Properties
Density
1.583
Computational chemical data
  • Molecular Weight:162.167g/mol
  • Molecular Formula:C7H9NO3
  • Compound Is Canonicalized:True
  • Exact Mass:162.059
  • Monoisotopic Mass:162.059
  • Complexity:163
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:38.9A^2
  • Heavy Atom Count:12
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcYBzAQAAAAAAAAAAAAAAAAAAAAAAAAA8QAAAAAAAAACx8AAAHQAQAAAADAjBGgw8wNJIEACg AjRnRACCgCAxAiAI2CA4ZJgIIGLAkJGEIAhgkADIyAcQgIAOgAAAQAASAAAAAACAACQAAAAAAAAA AA==
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