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Basic information
- Standard SMILES
CCCN1CCC(c2ccc(-c3nc4cccc(C(N)=O)c4o3)c(F)c2)CC1- InChIKey
XUJCXBITZWQWAF-UHFFFAOYSA-N- Molecular formula
- C22H24FN3O2
- Average molar mass
- 381.4 g/mol
- Monoisotopic mass
- 381.18525518
Names & identifiers
- Preferred name
- 2-(2-Fluoro-4-(1-propylpiperidin-4-yl)phenyl)benzo[d]oxazole-7-carboxamide
- IUPAC
- 2-[2-fluoro-4-(1-propylpiperidin-4-yl)phenyl]-1,3-benzoxazole-7-carboxamide
Names & synonyms
SCHEMBL208002XUJCXBITZWQWAF-UHFFFAOYSA-N2-(2-fluoro-4-(1-propylpiperidin-4-yl)phenyl)benzo[d]oxazole-7-carboxamide
Database identifiers
- PubChem CID
- 44181561
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 72.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 540
Related reactions
2 records
Compound notes
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