5,6-Dihydro-2H,4H-[1,3]oxazolo[5,4,3-ij]quinoline-2-thione
Basic information
- CAS
72696-21-0- Standard SMILES
S=c1oc2cccc3c2n1CCC3- InChIKey
FAJXOBCXOGCRIQ-UHFFFAOYSA-N- Molecular formula
- C10H9NOS
- Average molar mass
- 191.25 g/mol
- Monoisotopic mass
- 191.04048508
Names & identifiers
- Preferred name
- 5,6-Dihydro-2H,4H-[1,3]oxazolo[5,4,3-ij]quinoline-2-thione
- IUPAC
- 3-oxa-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-2-thione
Names & synonyms
72696-21-0NSC165705DTXSID703044265,6-Dihydro-2H,4H-[1,3]oxazolo[5,4,3-ij]quinoline-2-thioneNSC-165705
Database identifiers
- CAS
72696-21-0- PubChem CID
- 295995
- DTXSID
DTXSID70304426
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 243
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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