Basic information
- CAS
351224-63-0- Standard SMILES
CCOc1cccc2c1NC(C)(C)c1sn(-c3ccc(F)cc3)c(=S)c1-2- InChIKey
OPNQVWBJYNLXQX-UHFFFAOYSA-N- Molecular formula
- C20H19FN2OS2
- Average molar mass
- 386.5 g/mol
- Monoisotopic mass
- 386.09228374
Names & identifiers
- Preferred name
- 6-ethoxy-2-(4-fluorophenyl)-4,4-dimethyl-4,5-dihydroisothiazolo[5,4-c]quinoline-1(2H)-thione
- IUPAC
- 6-ethoxy-2-(4-fluorophenyl)-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
- English name
- 6-ethoxy-2-(4-fluorophenyl)-4,4-dimethyl-4,5-dihydroisothiazolo[5,4-c]quinoline-1(2H)-thione
- Molecular formula
- C20H19FN2OS2
- Molecular weight
- 386.51
Names & synonyms
351224-63-06-ethoxy-2-(4-fluorophenyl)-4,4-dimethyl-4,5-dihydroisothiazolo[5,4-c]quinoline-1(2H)-thione6-ethoxy-2-(4-fluorophenyl)-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thioneOprea1_599845STK508676AKOS001625969AJ-292/13093028SR-01000430499SR-01000430499-16-ethoxy-2-(4-fluorophenyl)-4,4-dimethyl-4,5-dihydro[1,2]thiazolo[5,4-c]quinoline-1(2H)-thioneIsothiazolo[5,4-c]quinoline-1(2H)-thione, 6-ethoxy-2-(4-fluorophenyl)-4,5-dihydro-4,4-dimethyl-
Database identifiers
- CAS
351224-63-0- PubChem CID
- 1212158
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 81.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 601
Chemistry & industry
Suppliers2 total
Interbioscreen Ltd.[email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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