6-methyl-2H-triazolo[4,5-d]pyrimidin-7-one
Basic information
- CAS
61383-06-0- Standard SMILES
Cn1cnc2n[nH]nc2c1=O- InChIKey
CTWROIWRZJAKKE-UHFFFAOYSA-N- Molecular formula
- C5H5N5O
- Average molar mass
- 151.13 g/mol
- Monoisotopic mass
- 151.0494098
Names & identifiers
- Preferred name
- 6-methyl-2H-triazolo[4,5-d]pyrimidin-7-one
- IUPAC
- 6-methyl-2H-triazolo[4,5-d]pyrimidin-7-one
Names & synonyms
NSC31792861383-06-0DTXSID70317551NSC-3179286-Methyl-2,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Database identifiers
- CAS
61383-06-0- PubChem CID
- 330306
- DTXSID
DTXSID70317551
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 215
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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