4-(2-(5-Fluoro-6-methoxypyridin-3-ylamino)-5-(2-morpholinopropan-2-yl)pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine
Basic information
- Standard SMILES
COc1ncc(Nc2ncc(C(C)(C)N3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F- InChIKey
FXICDGUYHGAJQR-UHFFFAOYSA-N- Molecular formula
- C22H27FN8O2
- Average molar mass
- 454.5 g/mol
Names & identifiers
- Preferred name
- 4-(2-(5-Fluoro-6-methoxypyridin-3-ylamino)-5-(2-morpholinopropan-2-yl)pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine
- IUPAC
- 4-[2-[(5-fluoro-6-methoxy-3-pyridinyl)amino]-5-(2-morpholin-4-ylpropan-2-yl)-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine
Names & synonyms
SCHEMBL115939CHEMBL3646573FXICDGUYHGAJQR-UHFFFAOYSA-NBDBM125427US8772480, 2814-(2-(5-fluoro-6-methoxypyridin-3-ylamino)-5-(2-morpholinopropan-2-yl)pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine
Database identifiers
- PubChem CID
- 59548321
- ChEMBL
CHEMBL3646573
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 625
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Related reactions
3 records
Compound notes
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