Basic information
- Standard SMILES
CS(=O)(=O)c1nccc(-c2cccnc2)n1- InChIKey
YOORFANBYYVNMQ-UHFFFAOYSA-N- Molecular formula
- C10H9N3O2S
- Average molar mass
- 235.26 g/mol
Names & identifiers
- Preferred name
- 2-(Methylsulfonyl)-4-(pyridin-3-yl)pyrimidine
- IUPAC
- 2-methylsulfonyl-4-pyridin-3-ylpyrimidine
Names & synonyms
2-(methylsulfonyl)-4-(pyridin-3-yl)pyrimidine637354-25-72-(Methylsulfonyl)-4-(pyridin-3-yl) pyriMidine2-mesyl-4-(3-pyridyl)pyrimidine2-methylsulfonyl-4-pyridin-3-ylpyrimidine2-(Methylsulfonyl)-4-(3-pyridinyl)pyrimidineMFCD182550982-(methylsulfonyl)-4-(3-pyridyl)pyrimidinePyrimidine, 2-(methylsulfonyl)-4-(3-pyridinyl)-FLUM-001SCHEMBL3572760YOORFANBYYVNMQ-UHFFFAOYSA-N
Show more names
SY028072DB-3294582-Methanesulfonyl-4-pyridin-3-yl-pyrimidine2-methylsulfonyl-4-(pyridin-3-yl)pyrimidineH36400
Database identifiers
- PubChem CID
- 46909855
- Nikkaji
- J2.885.568K
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 325
Related reactions
7 records
Compound notes
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