Basic information
- Standard SMILES
CN(C)Cc1ccc(OC2CN(C(=O)c3nnc(-c4ccccc4)o3)C2)c(F)c1F- InChIKey
YGXDBYDSMNYJAB-UHFFFAOYSA-N- Molecular formula
- C21H20F2N4O3
- Average molar mass
- 414.4 g/mol
- Monoisotopic mass
- 414.15034684
Names & identifiers
- Preferred name
- (3-(4-((Dimethylamino)methyl)-2,3-difluorophenoxy)azetidin-1-yl)(5-phenyl-1,3,4-oxadiazol-2-yl)methanone
- IUPAC
- [3-[4-[(dimethylamino)methyl]-2,3-difluorophenoxy]azetidin-1-yl]-(5-phenyl-1,3,4-oxadiazol-2-yl)methanone
Names & synonyms
SCHEMBL320884YGXDBYDSMNYJAB-UHFFFAOYSA-N(3-(4-((Dimethylamino)methyl)-2,3-difluorophenoxy)azetidin-1-yl)(5-phenyl-1,3,4-oxadiazol-2-yl)methanone
Database identifiers
- PubChem CID
- 56598262
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 71.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 587
Related reactions
2 records
Compound notes
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