Basic information
- Standard SMILES
CNC(=O)[C@@H](NC(=O)n1nc(-c2ccc(F)c(F)c2)c2c1CCC(O)C2)C(C)(C)C- InChIKey
CZCYAMFEZYCAEH-VMHBGOFLSA-N- Molecular formula
- C21H26F2N4O3
- Average molar mass
- 420.5 g/mol
Names & identifiers
- Preferred name
- 3-(3,4-difluorophenyl)-N-((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-5-hydroxy-4,5,6,7-tetrahydro-1H-indazole-1-carboxamide
- IUPAC
- 3-(3,4-difluorophenyl)-N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-hydroxy-4,5,6,7-tetrahydroindazole-1-carboxamide
Names & synonyms
SCHEMBL1337646CZCYAMFEZYCAEH-VMHBGOFLSA-N3-(3,4-difluorophenyl)-N-((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-5-hydroxy-4,5,6,7-tetrahydro-1H-indazole-1-carboxamide
Database identifiers
- PubChem CID
- 46863563
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 96.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 644
Related reactions
2 records
Compound notes
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