Basic information
- Standard SMILES
CCCCC(=O)N1CCC(c2nc(CCc3ccccc3)cs2)CC1- InChIKey
DWDBHDPZRPUUME-UHFFFAOYSA-N- Molecular formula
- C21H28N2OS
- Average molar mass
- 356.5 g/mol
Names & identifiers
- Preferred name
- 1-{4-[4-(2-Phenylethyl)-1,3-thiazol-2-yl]piperidin-1-yl}pentan-1-one
- IUPAC
- 1-[4-[4-(2-phenylethyl)-1,3-thiazol-2-yl]piperidin-1-yl]pentan-1-one
Names & synonyms
SCHEMBL1774918DWDBHDPZRPUUME-UHFFFAOYSA-N1-{4-[4-(2-Phenylethyl)-1,3-thiazol-2-yl]piperidin-1-yl}pentan-1-one
Database identifiers
- PubChem CID
- 67156872
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 403
Related reactions
2 records
Compound notes
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