2-Chloro-4-[2-[2,5-dimethyl-1-[3-(trifluoromethoxy)phenyl]imidazol-4-yl]ethynyl]pyridine
Basic information
- CAS
871362-32-2- Standard SMILES
Cc1nc(C#Cc2ccnc(Cl)c2)c(C)n1-c1cccc(OC(F)(F)F)c1- InChIKey
OMWLMTSXTVGVPP-UHFFFAOYSA-N- Molecular formula
- C19H13ClF3N3O
- Average molar mass
- 391.8 g/mol
- Monoisotopic mass
- 391.0699242
Names & identifiers
- Preferred name
- 2-Chloro-4-[2-[2,5-dimethyl-1-[3-(trifluoromethoxy)phenyl]imidazol-4-yl]ethynyl]pyridine
- IUPAC
- 2-chloro-4-[2-[2,5-dimethyl-1-[3-(trifluoromethoxy)phenyl]imidazol-4-yl]ethynyl]pyridine
Names & synonyms
2-chloro-4-[2-[2,5-dimethyl-1-[3-(trifluoromethoxy)phenyl]imidazol-4-yl]ethynyl]pyridineSCHEMBL608787OMWLMTSXTVGVPP-UHFFFAOYSA-NDTXSID501119730871362-32-22-Chloro-4-({2,5-dimethyl-1-[3-(trifluoromethoxy)phenyl]-1H-imidazol-4-yl}ethynyl)pyridine2-Chloro-4-[2-[2,5-dimethyl-1-[3-(trifluoromethoxy)phenyl]-1H-imidazol-4-yl]ethynyl]pyridine
Database identifiers
- CAS
871362-32-2- PubChem CID
- 11596294
- DTXSID
DTXSID501119730
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 39.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 576
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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