Basic information
- Standard SMILES
Cc1nc(C=Cc2nc3ccc(F)cc3c(=O)n2-c2ccccc2Br)cs1- InChIKey
ZPBIDIVCSMTQLZ-UHFFFAOYSA-N- Molecular formula
- C20H13BrFN3OS
- Average molar mass
- 442.3 g/mol
- Monoisotopic mass
- 440.99467
Names & identifiers
- Preferred name
- 3-(2-bromo-phenyl)-6-fluoro-2-[2-(2-methyl-thiazol-4-yl)-vinyl]-3H-quinazolin-4-one
- IUPAC
- 3-(2-bromophenyl)-6-fluoro-2-[2-(2-methyl-1,3-thiazol-4-yl)ethenyl]quinazolin-4-one
Names & synonyms
SCHEMBL6601902ZPBIDIVCSMTQLZ-UHFFFAOYSA-N3-(2-bromo-phenyl)-6-fluoro-2-[2-(2-methyl-thiazol-4-yl)-vinyl]-3H-quinazolin-4-one
Database identifiers
- PubChem CID
- 54558788
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 630
Related reactions
3 records
Compound notes
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