Basic information
- Standard SMILES
O=C1C(=O)N(Cc2ccccc2F)c2ccc(S(=O)(=O)N3CC[C@H]3COc3ccccc3)cc21- InChIKey
GCQVILHNVZSRTL-SFHVURJKSA-N- Molecular formula
- C25H21FN2O5S
- Average molar mass
- 480.5 g/mol
Names & identifiers
- Preferred name
- (S)-1-(2-fluorobenzyl)-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dione
- IUPAC
- 1-[(2-fluorophenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonylindole-2,3-dione
Names & synonyms
(S)-1-(2-fluorobenzyl)-5-(2-phenoxymethyl-azetidine-1-sulfonyl)-1H-indole-2,3-dioneCHEMBL200493SCHEMBL4150262BDBM10344GCQVILHNVZSRTL-SFHVURJKSA-N1-[(2-fluorophenyl)methyl]-5-{[(2S)-2-(phenoxymethyl)azetidine-1-]sulfonyl}-2,3-dihydro-1H-indole-2,3-dione
Database identifiers
- PubChem CID
- 11634372
- ChEMBL
CHEMBL200493
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 871
Related reactions
1 records
Compound notes
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