Basic information
- Standard SMILES
O=c1[nH]c2c(F)cccc2c(=O)n1-c1cccc(Br)c1Cl- InChIKey
CPVPSYNSQYRLHP-UHFFFAOYSA-N- Molecular formula
- C14H7BrClFN2O2
- Average molar mass
- 369.57 g/mol
Names & identifiers
- Preferred name
- 3-(3-bromo-2-chlorophenyl)-8-fluoroquinazoline-2,4(1H,3H)-dione
- IUPAC
- 3-(3-bromo-2-chlorophenyl)-8-fluoro-1H-quinazoline-2,4-dione
Names & synonyms
SCHEMBL16320388CPVPSYNSQYRLHP-UHFFFAOYSA-N3-(3-bromo-2-chlorophenyl)-8-fluoroquinazoline-2,4(1H,3H)-dione
Database identifiers
- PubChem CID
- 117761112
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 453
Related reactions
2 records
Compound notes
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