N-[1-(4-Chloro-3-fluorobenzyl)-4-piperidinyl]-3-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]propanamide
Basic information
- Standard SMILES
O=C(CCc1nc(-c2ccccn2)no1)NC1CCN(Cc2ccc(Cl)c(F)c2)CC1- InChIKey
ZOWXDMIXBVVFEW-UHFFFAOYSA-N- Molecular formula
- C22H23ClFN5O2
- Average molar mass
- 443.9 g/mol
- Monoisotopic mass
- 443.1524308
Names & identifiers
- Preferred name
- N-[1-(4-Chloro-3-fluorobenzyl)-4-piperidinyl]-3-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]propanamide
- IUPAC
- N-[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-4-yl]-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)propanamide
Names & synonyms
SCHEMBL4031536ZOWXDMIXBVVFEW-UHFFFAOYSA-NN-[1-(4-Chloro-3-fluorobenzyl)-4-piperidinyl]-3-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]propanamide
Database identifiers
- PubChem CID
- 22396154
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 580
Related reactions
1 records
Compound notes
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