Basic information
- Standard SMILES
CSc1nccc2nc(N)nn12- InChIKey
HTOHFJVBKDUQOU-UHFFFAOYSA-N- Molecular formula
- C6H7N5S
- Average molar mass
- 181.22 g/mol
Names & identifiers
- Preferred name
- 5-Methylsulfanyl-[1,2,4]triazolo[1,5-c]pyrimidin-2-ylamine
- IUPAC
- 5-methylsulfanyl-[1,2,4]triazolo[1,5-c]pyrimidin-2-amine
Names & synonyms
SCHEMBL3582788HTOHFJVBKDUQOU-UHFFFAOYSA-N5-methylsulfanyl-[1,2,4]triazolo[1,5-c]pyrimidin-2-ylamine
Database identifiers
- PubChem CID
- 59589529
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 94.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 166
Related reactions
4 records
Compound notes
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