Basic information
- Standard SMILES
CC1c2ccccc2-c2cc(Br)ccc2N1S(=O)(=O)c1ccc(O)c(F)c1- InChIKey
MXDIGCJKUXQJNA-UHFFFAOYSA-N- Molecular formula
- C20H15BrFNO3S
- Average molar mass
- 448.3 g/mol
Names & identifiers
- Preferred name
- 4-[(2-bromo-6-methylphenanthridin-5(6H)-yl)sulfonyl]-2-fluorophenol
- IUPAC
- 4-[(2-bromo-6-methyl-6H-phenanthridin-5-yl)sulfonyl]-2-fluorophenol
Names & synonyms
SCHEMBL5211630MXDIGCJKUXQJNA-UHFFFAOYSA-N4-[(2-bromo-6-methylphenanthridin-5(6H)-yl)sulfonyl]-2-fluorophenol
Database identifiers
- PubChem CID
- 10095178
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 642
Related reactions
2 records
Compound notes
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