Basic information
- Standard SMILES
CCc1nc2[nH]c(-c3ccc4c(cnn4C(C)=O)c3)cc(=O)n2n1- InChIKey
UOZKOINUZPWDGQ-UHFFFAOYSA-N- Molecular formula
- C16H14N6O2
- Average molar mass
- 322.32 g/mol
- Monoisotopic mass
- 322.11782371
Names & identifiers
- Preferred name
- 5-(1-acetyl-1H-indazol-5-yl)-2-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
- IUPAC
- 5-(1-acetylindazol-5-yl)-2-ethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
Names & synonyms
SCHEMBL17106432UOZKOINUZPWDGQ-UHFFFAOYSA-N5-(1-acetyl-1H-indazol-5-yl)-2-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one5-(1-acetyl-1H-indazol-5-yl)-2-ethyl-[1,2,4]triazolo[1,5-alpha]pyrimidin-7(4H)-one
Database identifiers
- PubChem CID
- 118389283
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 92 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 682
Related reactions
2 records
Compound notes
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