Basic information
- Standard SMILES
OC(COc1cccc(-c2noc3ncccc23)c1)CN1CCC(Oc2cccc(Cl)c2)CC1- InChIKey
RHUNBODMELYZBY-UHFFFAOYSA-N- Molecular formula
- C26H26ClN3O4
- Average molar mass
- 480 g/mol
- Monoisotopic mass
- 479.161184
Names & identifiers
- Preferred name
- 1-[4-(3-Chlorophenoxy)piperidin-1-yl]-3-[3-([1,2]oxazolo[5,4-b]pyridin-3-yl)phenoxy]propan-2-ol
- IUPAC
- 1-[4-(3-chlorophenoxy)piperidin-1-yl]-3-[3-([1,2]oxazolo[5,4-b]pyridin-3-yl)phenoxy]propan-2-ol
Names & synonyms
SCHEMBL1382303
Database identifiers
- PubChem CID
- 67012799
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 623
Related reactions
1 records
Compound notes
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