N-(3-chloro-4-fluorophenyl)pyridine-3-carboxamide
Basic information
- CAS
24303-09-1- Standard SMILES
O=C(Nc1ccc(F)c(Cl)c1)c1cccnc1- InChIKey
SHZSADZRVMGPOK-UHFFFAOYSA-N- Molecular formula
- C12H8ClFN2O
- Average molar mass
- 250.65 g/mol
- Monoisotopic mass
- 250.0309187
Names & identifiers
- Preferred name
- N-(3-chloro-4-fluorophenyl)pyridine-3-carboxamide
- IUPAC
- N-(3-chloro-4-fluorophenyl)pyridine-3-carboxamide
Names & synonyms
N-(3-chloro-4-fluorophenyl)pyridine-3-carboxamide24303-09-1N-(3-Chloro-4-fluoro-phenyl)-nicotinamideCambridge id 5570787Oprea1_164769Oprea1_739727MLS001208111CHEMBL1476255REGID_for_CID_771964SCHEMBL30408071DTXSID301329876STK051052
Show more names
AKOS000673405N-(3-chloro-4-fluorophenyl)nicotinamideSMR000514851ST50687269AB00089728-01AG-690/11635338N-(3-chloro-4-fluorophenyl)-3-pyridylcarboxamideSR-01000407251
Database identifiers
- CAS
24303-09-1- PubChem CID
- 771964
- DTXSID
DTXSID301329876- ChEMBL
CHEMBL1476255
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 277
Experimental & physicochemical properties
Solubility24.5 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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