[1,3]Thiazolo[5,4-H]quinoline
Basic information
- CAS
233-94-3- Standard SMILES
c1cnc2c(c1)ccc1scnc12- InChIKey
ZOWMUDMFTLGNIK-UHFFFAOYSA-N- Molecular formula
- C10H6N2S
- Average molar mass
- 186.24 g/mol
- Monoisotopic mass
- 186.02516937
Names & identifiers
- Preferred name
- [1,3]Thiazolo[5,4-H]quinoline
- IUPAC
- [1,3]thiazolo[5,4-h]quinoline
- English name
- Thiazolo[5,4-h]quinoline (8CI,9CI)
- Molecular formula
- C10H6N2S
- Molecular weight
- 186.23
Names & synonyms
233-94-3[1,3]THIAZOLO[5,4-H]QUINOLINESCHEMBL3750917SCHEMBL10690151DTXSID10603243Thiazolo[5,4-h]quinoline (8CI,9CI)
Database identifiers
- CAS
233-94-3- PubChem CID
- 20183536
- DTXSID
DTXSID10603243
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 197
Physicochemical properties
- Melting point
- 158 °C · 158 °C(Solv: benzene (71-43-2); ligroine (8032-32-4))
- Boiling point
- 363 · 363.0±15.0 °C(Predicted)
- Density
- 1.394 · 1.394±0.06 g/cm3(Predicted)
- pka
- 0.81 · 0.81±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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