Basic information
- Standard SMILES
Cc1cc([C@](C)(O)C#Cc2ccc3c(C(N)=O)nn(-c4ccnc(N)n4)c3c2)no1- InChIKey
YOZWCFKMDNGNBT-HXUWFJFHSA-N- Molecular formula
- C20H17N7O3
- Average molar mass
- 403.4 g/mol
Names & identifiers
- Preferred name
- 1-(2-aminopyrimidin-4-yl)-6-[(3R)-3-hydroxy-3-(5-methyl-1,2-oxazol-3-yl)but-1-yn-1-yl]-1H-indazole-3-carboxamide
- IUPAC
- 1-(2-aminopyrimidin-4-yl)-6-[(3R)-3-hydroxy-3-(5-methyl-1,2-oxazol-3-yl)but-1-ynyl]indazole-3-carboxamide
Names & synonyms
SCHEMBL11970742YOZWCFKMDNGNBT-HXUWFJFHSA-N1-(2-aminopyrimidin-4-yl)-6-[(3R)-3-hydroxy-3-(5-methyl-1,2-oxazol-3-yl)but-1-yn-1-yl]-1H-indazole-3-carboxamide
Database identifiers
- PubChem CID
- 60165045
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 724
Related reactions
1 records
Compound notes
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