Basic information
- Standard SMILES
Cc1cccc(CN2CCN(c3cccc4nc(N)nc(N)c34)CC2)c1F- InChIKey
KVYCXSLIZWQBIR-UHFFFAOYSA-N- Molecular formula
- C20H23FN6
- Average molar mass
- 366.4 g/mol
Names & identifiers
- Preferred name
- 5-[4-(2-Fluoro-3-methyl-benzyl)-piperazin-1-yl]-quinazoline-2,4-diamine
- IUPAC
- 5-[4-[(2-fluoro-3-methylphenyl)methyl]piperazin-1-yl]quinazoline-2,4-diamine
Names & synonyms
SCHEMBL2166641KVYCXSLIZWQBIR-UHFFFAOYSA-N5-[4-(2-Fluoro-3-methyl-benzyl)-piperazin-1-yl]-quinazoline-2,4-diamine
Database identifiers
- PubChem CID
- 25004871
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 84.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 485
Related reactions
2 records
Compound notes
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