Basic information
- Standard SMILES
Cc1ccc(OC2CCN(C(=O)CNc3ccc4[nH]c(=O)sc4c3)CC2)cc1- InChIKey
ZEUIKIZUAUXWSN-UHFFFAOYSA-N- Molecular formula
- C21H23N3O3S
- Average molar mass
- 397.5 g/mol
- Monoisotopic mass
- 397.14601278
Names & identifiers
- Preferred name
- 1-(4-p-Tolyloxy-piperidin-1-yl)-2-(2-oxo-2,3-dihydro-benzothiazol-6-yl-amino)-ethanone
- IUPAC
- 6-[[2-[4-(4-methylphenoxy)piperidin-1-yl]-2-oxoethyl]amino]-3H-1,3-benzothiazol-2-one
Names & synonyms
SCHEMBL4577807ZEUIKIZUAUXWSN-UHFFFAOYSA-N1-(4-p-Tolyloxy-piperidin-1-yl)-2-(2-oxo-2,3-dihydro-benzothiazol-6-yl-amino)-ethanone1-(4-p-tolyloxy-piperidin-1-yl)-2-(2-oxo-2,3-dihydro-benzothiazole-6-yl-amino)-ethanone
Database identifiers
- PubChem CID
- 69100398
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 559
Related reactions
2 records
Compound notes
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