Basic information
- Standard SMILES
CCn1c(NC(C)(C)C)nc2c(Br)c(F)ccc2c1=O- InChIKey
HDXHCUNXZUAZQV-UHFFFAOYSA-N- Molecular formula
- C14H17BrFN3O
- Average molar mass
- 342.21 g/mol
Names & identifiers
- Preferred name
- 8-bromo-2-(tert-butylamino)-3-ethyl-7-fluoroquinazolin-4(3H)-one
- IUPAC
- 8-bromo-2-(tert-butylamino)-3-ethyl-7-fluoroquinazolin-4-one
Names & synonyms
SCHEMBL15244035HDXHCUNXZUAZQV-UHFFFAOYSA-N8-bromo-2-(tert-butylamino)-3-ethyl-7-fluoroquinazolin-4(3H)-one
Database identifiers
- PubChem CID
- 89793910
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 421
Related reactions
1 records
Compound notes
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