Basic information
- Standard SMILES
N#Cc1nc2ccc3ncnc(Nc4ccc(F)cc4Br)c3c2s1- InChIKey
ICZOPYGRGOSRQB-UHFFFAOYSA-N- Molecular formula
- C16H7BrFN5S
- Average molar mass
- 400.2 g/mol
Names & identifiers
- Preferred name
- 9-(2-Bromo-4-fluorophenylamino)thiazolo[5,4-f]quinazoline-2-carbonitrile
- IUPAC
- 9-(2-bromo-4-fluoroanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carbonitrile
Names & synonyms
SCHEMBL14733541ICZOPYGRGOSRQB-UHFFFAOYSA-N9-(2-Bromo-4-fluorophenylamino)thiazolo[5,4-f]quinazoline-2-carbonitrile
Database identifiers
- PubChem CID
- 71277787
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 516
Related reactions
1 records
Compound notes
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