Basic information
- Standard SMILES
Fc1ccc(Oc2cc(Br)cnc2Nc2nc(CCc3ccccc3)cs2)cc1- InChIKey
VNISZGHWLHEYTM-UHFFFAOYSA-N- Molecular formula
- C22H17BrFN3OS
- Average molar mass
- 470.4 g/mol
- Monoisotopic mass
- 469.02597
Names & identifiers
- Preferred name
- 5-bromo-3-(4-fluorophenoxy)-N-(4-phenethylthiazol-2-yl)pyridin-2-amine
- IUPAC
- N-[5-bromo-3-(4-fluorophenoxy)-2-pyridinyl]-4-(2-phenylethyl)-1,3-thiazol-2-amine
Names & synonyms
SCHEMBL1328914VNISZGHWLHEYTM-UHFFFAOYSA-N5-bromo-3-(4-fluorophenoxy)-N-(4-phenethylthiazol-2-yl)pyridin-2-amine
Database identifiers
- PubChem CID
- 57742586
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 491
Related reactions
3 records
Compound notes
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