5-(5-(Difluoromethyl)-1,2,4-oxadiazol-3-yl)nicotinic acid
Basic information
- Standard SMILES
O=C(O)c1cncc(-c2noc(C(F)F)n2)c1- InChIKey
LTSCUJQADCLOBO-UHFFFAOYSA-N- Molecular formula
- C9H5F2N3O3
- Average molar mass
- 241.15 g/mol
Names & identifiers
- Preferred name
- 5-(5-(Difluoromethyl)-1,2,4-oxadiazol-3-yl)nicotinic acid
- IUPAC
- 5-[5-(difluoromethyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylic acid
Names & synonyms
5-(5-(Difluoromethyl)-1,2,4-oxadiazol-3-yl)nicotinic acidSCHEMBL2224912
Database identifiers
- PubChem CID
- 67323936
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 89.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 293
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
2 records
Compound notes
Loading…