(2R)-N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-iodo-2-methylpropanamide
Basic information
- CAS
206193-19-3- Standard SMILES
C[C@](O)(CI)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1- InChIKey
KMBKIAPXINYEHM-NSHDSACASA-N- Molecular formula
- C12H10F3IN2O2
- Average molar mass
- 398.12 g/mol
- Monoisotopic mass
- 397.97391
Names & identifiers
- Preferred name
- (2R)-N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-iodo-2-methylpropanamide
- IUPAC
- (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-iodo-2-methylpropanamide
Names & synonyms
(2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-3-iodo-2-methylpropanamide206193-19-3(2R)-N-(4-Cyano-3-(trifluoromethyl)phenyl)-2-hydroxy-3-iodo-2-methylpropanamideRefChem:206695CHEMBL178354BDBM18700KMBKIAPXINYEHM-NSHDSACASA-NDTXSID801135391(R)-N-[3-(Trifluoromethyl)-4-cyanophenyl]-3-iodo-2-hydroxy-2-methylpropanamideR-4
Database identifiers
- CAS
206193-19-3- PubChem CID
- 9800976
- DTXSID
DTXSID801135391- ChEMBL
CHEMBL178354- Nikkaji
- J949.144I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 421
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Compound notes
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