Basic information
- Standard SMILES
CC(=O)N[C@@H](C)COc1cc2oc(-c3cc(F)c(OCC4CC4(F)F)cc3F)nc2cn1- InChIKey
BRYDZVHYQXFCFE-NUHJPDEHSA-N- Molecular formula
- C21H19F4N3O4
- Average molar mass
- 453.4 g/mol
- Monoisotopic mass
- 453.13116874
Names & identifiers
- Preferred name
- N-((2S)-1-((2-(4-((2,2-difluorocyclopropyl)methoxy)-2,5-difluorophenyl)[1,3]oxazolo[4,5-c]pyridin-6-yl)oxy)propan-2-yl)acetamide
- IUPAC
- N-[(2S)-1-[[2-[4-[(2,2-difluorocyclopropyl)methoxy]-2,5-difluorophenyl]-[1,3]oxazolo[4,5-c]pyridin-6-yl]oxy]propan-2-yl]acetamide
Names & synonyms
N-((2S)-1-((2-(4-((2,2-difluorocyclopropyl)methoxy)-2,5-difluorophenyl)[1,3]oxazolo[4,5-c]pyridin-6-yl)oxy)propan-2-yl)acetamideSCHEMBL14908372
Database identifiers
- PubChem CID
- 86731301
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 86.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 675
Related reactions
1 records
Compound notes
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