3,3-bis[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]-1,3-dihydro-2H-indol-2-one
Basic information
- CAS
330593-18-5- Standard SMILES
CC(C)(C)c1cc(SC2(Sc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)C(=O)Nc3ccccc32)cc(C(C)(C)C)c1O- InChIKey
XGZANURLSVLKDF-UHFFFAOYSA-N- Molecular formula
- C36H47NO3S2
- Average molar mass
- 605.9 g/mol
- Monoisotopic mass
- 605.29973671
Names & identifiers
- Preferred name
- 3,3-bis[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]-1,3-dihydro-2H-indol-2-one
- IUPAC
- 3,3-bis[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl]-1H-indol-2-one
Names & synonyms
3,3-bis[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]-1,3-dihydro-2H-indol-2-oneDTXSID701129244STK525018AKOS001716537NCGC00336703-01330593-18-5AB01330327-023,3-bis((3,5-di-tert-butyl-4-hydroxyphenyl)thio)indolin-2-one3,3-Bis[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]thio]-1,3-dihydro-2H-indol-2-one
Database identifiers
- CAS
330593-18-5- PubChem CID
- 3286199
- DTXSID
DTXSID701129244
Properties
Computed structural properties
- XLogP
- 11.2
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 851
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Compound notes
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