Basic information
- CAS
22977-76-0- Standard SMILES
C/C=C/CN1C(S)=CCc2ccccc21- InChIKey
FSNOWWHSPPAZFY-NSCUHMNNSA-N- Molecular formula
- C13H15NS
- Average molar mass
- 217.33 g/mol
Names & identifiers
- Preferred name
- 1-[(E)-but-2-enyl]-4H-quinoline-2-thiol
- IUPAC
- 1-[(E)-but-2-enyl]-4H-quinoline-2-thiol
- English name
- Carbostyril, 1-(2-butenyl)thio- (8CI)
- Molecular formula
- C13H13NS
- Molecular weight
- 0
Names & synonyms
Carbostyril, 1-(2-butenyl)thio- (8CI)
Database identifiers
- CAS
22977-76-0
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 4.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 270
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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