Basic information
- Standard SMILES
COc1cncc(-c2ccc3c(c2)c(-c2cncc(O[C@@H]4CCCN(C(=O)OC(C)(C)C)C4)n2)nn3C2CCCCO2)c1- InChIKey
DHLMARHNEYNVFU-WIZGVZBGSA-N- Molecular formula
- C32H38N6O5
- Average molar mass
- 586.7 g/mol
- Monoisotopic mass
- 586.29036833
Names & identifiers
- Preferred name
- tert-butyl (3R)-3-((6-(5-(5-methoxy-3-pyridinyl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-3-yl)-2-pyrazinyl)oxy)-1-piperidinecarboxylate
- IUPAC
- tert-butyl (3R)-3-[6-[5-(5-methoxy-3-pyridinyl)-1-(oxan-2-yl)indazol-3-yl]pyrazin-2-yl]oxypiperidine-1-carboxylate
Names & synonyms
DHLMARHNEYNVFU-WIZGVZBGSA-Ntert-butyl (3R)-3-((6-(5-(5-methoxy-3-pyridinyl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-3-yl)-2-pyrazinyl)oxy)-1-piperidinecarboxylate
Database identifiers
- PubChem CID
- 86709759
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 921
Related reactions
2 records
Compound notes
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