Basic information
- Standard SMILES
Cc1cnc(Nc2nc(N[C@@H](C)c3ncc(F)cn3)nc(N3CCOCC3)n2)s1- InChIKey
AJHRSQYSLUUMKB-NSHDSACASA-N- Molecular formula
- C17H20FN9OS
- Average molar mass
- 417.5 g/mol
Names & identifiers
- Preferred name
- N-[(1S)-1-(5-Fluoropyrimidin-2-yl)ethyl]-N'-(5-methyl-1,3-thiazol-2-yl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
- IUPAC
- 2-N-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-4-N-(5-methyl-1,3-thiazol-2-yl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
Names & synonyms
SCHEMBL2161187AJHRSQYSLUUMKB-NSHDSACASA-NN-[(1S)-1-(5-Fluoropyrimidin-2-yl)ethyl]-N'-(5-methyl-1,3-thiazol-2-yl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
Database identifiers
- PubChem CID
- 44548421
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 509
Related reactions
1 records
Compound notes
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