Basic information
- Standard SMILES
CC1CCN(C(=O)c2ccc(-c3nc4ccc(O)cc4s3)cc2)CC1- InChIKey
UVXJUVHXWBDMRN-UHFFFAOYSA-N- Molecular formula
- C20H20N2O2S
- Average molar mass
- 352.5 g/mol
Names & identifiers
- Preferred name
- [4-(6-Hydroxy-benzothiazol-2-yl)-phenyl]-(4-methyl-piperidin-1-yl)-methanone
- IUPAC
- [4-(6-hydroxy-1,3-benzothiazol-2-yl)phenyl]-(4-methylpiperidin-1-yl)methanone
Names & synonyms
SCHEMBL2549277SCHEMBL30406206UVXJUVHXWBDMRN-UHFFFAOYSA-N[4-(6-Hydroxy-benzothiazol-2-yl)-phenyl]-(4-methyl-piperidin-1-yl)-methanone
Database identifiers
- PubChem CID
- 67448530
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 81.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 472
Related reactions
2 records
Compound notes
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