Basic information
- Standard SMILES
O=C(CNc1ccc2[nH]c(=O)oc2c1)N1CCC(Oc2ccc(Cl)cc2)CC1- InChIKey
OREYJIKEROMQEE-UHFFFAOYSA-N- Molecular formula
- C20H20ClN3O4
- Average molar mass
- 401.8 g/mol
Names & identifiers
- Preferred name
- 6-{2-[4-(4-Chloro-phenoxy)-piperidin-1-yl]-2-oxo-ethylamino}-3h-benzoxazol-2-one
- IUPAC
- 6-[[2-[4-(4-chlorophenoxy)piperidin-1-yl]-2-oxoethyl]amino]-3H-1,3-benzoxazol-2-one
Names & synonyms
SCHEMBL4576753OREYJIKEROMQEE-UHFFFAOYSA-N6-{2-[4-(4-chloro-phenoxy)-piperidin-1-yl]-2-oxo-ethylamino}-3h-benzoxazol-2-one6-{2[-4-(4-Chloro-phenoxy)-piperidin-1-yl]-2-oxo-ethylamino}-3H-benzoxazol-2-one
Database identifiers
- PubChem CID
- 69099990
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 79.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 562
Related reactions
4 records
Compound notes
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