Basic information
- Standard SMILES
CNc1ncc2cc(OS(=O)(=O)C(F)(F)F)c(C)nc2n1- InChIKey
ZQAMRSXFXKKLOW-UHFFFAOYSA-N- Molecular formula
- C10H9F3N4O3S
- Average molar mass
- 322.27 g/mol
Names & identifiers
- Preferred name
- 7-Methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl trifluoromethanesulfonate
- IUPAC
- [7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl] trifluoromethanesulfonate
Names & synonyms
7-Methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl trifluoromethanesulfonate1454682-77-9[7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl] trifluoromethanesulfonate7-Methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yltrifluoromethanesulfonateSCHEMBL15263808SCHEMBL29427237DB-124450
Database identifiers
- PubChem CID
- 89809504
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 467
Related reactions
3 records
Compound notes
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