Basic information
- Standard SMILES
O=c1[nH]c2cc3ocnc3c(F)c2n1-c1ccc(Br)cc1Cl- InChIKey
IRSWNUNYUZMIKU-UHFFFAOYSA-N- Molecular formula
- C14H6BrClFN3O2
- Average molar mass
- 382.57 g/mol
Names & identifiers
- Preferred name
- 5-(4-bromo-2-chlorophenyl)-4-fluoro-5H-imidazo[4',5':4,5]benzo[1,2-d]oxazol-6(7H)-one
- IUPAC
- 5-(4-bromo-2-chlorophenyl)-4-fluoro-7H-imidazo[4,5-f][1,3]benzoxazol-6-one
Names & synonyms
SCHEMBL15130141IRSWNUNYUZMIKU-UHFFFAOYSA-N5-(4-bromo-2-chlorophenyl)-4-fluoro-5H-imidazo[4',5':4,5]benzo[1,2-d]oxazol-6(7H)-one
Database identifiers
- PubChem CID
- 89705369
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 473
Related reactions
3 records
Compound notes
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