Basic information
- Standard SMILES
Cn1cc(Br)cc(Nc2cc3n(n2)CCNC3)c1=O- InChIKey
QOUXBOVRJMECBY-UHFFFAOYSA-N- Molecular formula
- C12H14BrN5O
- Average molar mass
- 324.18 g/mol
- Monoisotopic mass
- 323.03817
Names & identifiers
- Preferred name
- 5-Bromo-1-methyl-3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylamino)pyridin-2(1H)-one
- IUPAC
- 5-bromo-1-methyl-3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylamino)pyridin-2-one
Names & synonyms
SCHEMBL1392936QOUXBOVRJMECBY-UHFFFAOYSA-N5-Bromo-1-methyl-3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylamino)pyridin-2(1H)-one
Database identifiers
- PubChem CID
- 58043785
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 449
Related reactions
11 records
Compound notes
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