N2-(4-bromo-2-fluorophenyl)-1,3-benzothiazol-2-amine
Basic information
- Standard SMILES
Fc1cc(Br)ccc1Nc1nc2ccccc2s1- InChIKey
UKUGIWVMVFUOSU-UHFFFAOYSA-N- Molecular formula
- C13H8BrFN2S
- Average molar mass
- 323.19 g/mol
- Monoisotopic mass
- 321.95756
Names & identifiers
- Preferred name
- N2-(4-bromo-2-fluorophenyl)-1,3-benzothiazol-2-amine
- IUPAC
- N-(4-bromo-2-fluorophenyl)-1,3-benzothiazol-2-amine
Names & synonyms
SCHEMBL1747973UKUGIWVMVFUOSU-UHFFFAOYSA-NAKOS008961534DB-096482N2-(4-bromo-2-fluorophenyl)-1,3-benzothiazol-2-amine330793-82-3
Database identifiers
- PubChem CID
- 21985682
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 53.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 294
Related reactions
5 records
Compound notes
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