6-((3-(4-(difluoromethoxy)benzylamino)isoxazol-5-yl)methoxy)quinolin-2(1H)-one
Basic information
- Standard SMILES
O=c1ccc2cc(OCc3cc(NCc4ccc(OC(F)F)cc4)no3)ccc2[nH]1- InChIKey
BIIXCKRSWSMHIM-UHFFFAOYSA-N- Molecular formula
- C21H17F2N3O4
- Average molar mass
- 413.4 g/mol
Names & identifiers
- Preferred name
- 6-((3-(4-(difluoromethoxy)benzylamino)isoxazol-5-yl)methoxy)quinolin-2(1H)-one
- IUPAC
- 6-[[3-[[4-(difluoromethoxy)phenyl]methylamino]-1,2-oxazol-5-yl]methoxy]-1H-quinolin-2-one
Names & synonyms
6-((3-(4-(difluoromethoxy)benzylamino)isoxazol-5-yl)methoxy)quinolin-2(1H)-oneSCHEMBL14816294
Database identifiers
- PubChem CID
- 71542040
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 85.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 601
Related reactions
1 records
Compound notes
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