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Basic information
- Standard SMILES
CC(CCc1ccc(F)cc1)Nc1nc(N)nc(C(C)C)n1- InChIKey
BAVQGTVRLCZEQU-UHFFFAOYSA-N- Molecular formula
- C16H22FN5
- Average molar mass
- 303.38 g/mol
- Monoisotopic mass
- 303.18592389
Names & identifiers
- Preferred name
- 2-Amino-4-isopropyl-6-[1-(4-fluorophenyl)-3-butylamino]-1,3,5-triazine
- IUPAC
- 2-N-[4-(4-fluorophenyl)butan-2-yl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine
Names & synonyms
SCHEMBL6250758BAVQGTVRLCZEQU-UHFFFAOYSA-N2-Amino-4-isopropyl-6-[1-(4-fluorophenyl)-3-butylamino]-1,3,5-triazine
Database identifiers
- PubChem CID
- 69720798
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 320
Related reactions
2 records
Compound notes
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