Basic information
- Standard SMILES
Nc1nc(N)c2c(N3CCN(Cc4ccc(F)cc4F)CC3)cccc2n1- InChIKey
IBHJCBZSKSVOLF-UHFFFAOYSA-N- Molecular formula
- C19H20F2N6
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.17175099
Names & identifiers
- Preferred name
- 5-[4-(2,4-Difluoro-benzyl)-piperazin-1-yl]-quinazoline-2,4-diamine
- IUPAC
- 5-[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]quinazoline-2,4-diamine
Names & synonyms
SCHEMBL2165879IBHJCBZSKSVOLF-UHFFFAOYSA-N5-[4-(2,4-Difluoro-benzyl)-piperazin-1-yl]-quinazoline-2,4-diamine
Database identifiers
- PubChem CID
- 25004534
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 84.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 489
Related reactions
2 records
Compound notes
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