Basic information
- Standard SMILES
Fc1ccc2nc(N3CC4CNCC4C3)ncc2c1- InChIKey
SYSNIJMNQQHUGU-UHFFFAOYSA-N- Molecular formula
- C14H15FN4
- Average molar mass
- 258.29 g/mol
- Monoisotopic mass
- 258.12807466
Names & identifiers
- Preferred name
- 6-Fluoro-2-(hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)quinazoline
- IUPAC
- 2-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-6-fluoroquinazoline
Names & synonyms
SCHEMBL6924601SCHEMBL29364564SYSNIJMNQQHUGU-UHFFFAOYSA-N6-Fluoro-2-(hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)quinazoline
Database identifiers
- PubChem CID
- 69939155
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 327
Related reactions
6 records
Compound notes
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