Basic information
- Standard SMILES
Clc1ccc(C=C2c3ccccc3CCc3sccc32)c(Cl)c1- InChIKey
BVACTHQJMFYKHQ-UHFFFAOYSA-N- Molecular formula
- C20H14Cl2S
- Average molar mass
- 357.3 g/mol
Names & identifiers
- Preferred name
- 4-(2,4-Dichloro-benzylidene)-9,10-dihydro-4h-1-thia-benzo[f]azulene
- IUPAC
- 2-[(2,4-dichlorophenyl)methylidene]-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaene
Names & synonyms
SCHEMBL4161636BVACTHQJMFYKHQ-UHFFFAOYSA-N4-(2,4-dichloro-benzylidene)-9,10-dihydro-4h-1-thia-benzo[f]azulene
Database identifiers
- PubChem CID
- 68937375
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 449
Related reactions
1 records
Compound notes
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