Basic information
- Standard SMILES
COC(=O)c1cccc(-n2nc(C)c3cc(C(=O)N4CCC5(CC4)CC(=O)c4cc(-c6cnn(C)c6)ccc4O5)ccc32)c1- InChIKey
FYEYNSLXNFJQNS-UHFFFAOYSA-N- Molecular formula
- C34H31N5O5
- Average molar mass
- 589.6 g/mol
Names & identifiers
- Preferred name
- Methyl 3-(3-methyl-5-{[6-(1-methyl-1H-pyrazol-4-yl)-4-oxospiro[chroman-2,4'-piperidin]-1'yl]carbonyl}-1H-indazol-1-yl)benzoate
- IUPAC
- methyl 3-[3-methyl-5-[6-(1-methylpyrazol-4-yl)-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carbonyl]indazol-1-yl]benzoate
Names & synonyms
SCHEMBL1501773FYEYNSLXNFJQNS-UHFFFAOYSA-NMethyl 3-(3-methyl-5-{[6-(1-methyl-1H-pyrazol-4-yl)-4-oxospiro[chroman-2,4'-piperidin]-1'yl]carbonyl}-1H-indazol-1-yl)benzoateMethyl 3-(3-methyl-5-{[6-(1-methyl-1H-pyrazol-4-yl)-4-oxospiro[chroman-2,4'-piperidin]-yl]carbonyl}-1H-indazol-1-yl)benzoate
Database identifiers
- PubChem CID
- 58208705
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,100
Related reactions
1 records
Compound notes
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