Basic information
- Standard SMILES
COc1ccc(CSc2ccccc2C(=O)N2CCN(C)CC2)cc1- InChIKey
BWPNACXBJLVXAO-UHFFFAOYSA-N- Molecular formula
- C20H24N2O2S
- Average molar mass
- 356.5 g/mol
Names & identifiers
- Preferred name
- N1-(S-(4-methoxybenzyl) thiosalicyloyl)-N4-methylpiperazine
- IUPAC
- [2-[(4-methoxyphenyl)methylsulfanyl]phenyl]-(4-methylpiperazin-1-yl)methanone
Names & synonyms
SCHEMBL6289816BWPNACXBJLVXAO-UHFFFAOYSA-NN1-(S-(4-methoxybenzyl) thiosalicyloyl)-N4-methylpiperazine
Database identifiers
- PubChem CID
- 69733570
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 58.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 418
Related reactions
3 records
Compound notes
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