Basic information
- Standard SMILES
CC1(C)COC(CS[C@@H](C(=O)N2C(=O)OC[C@@H]2c2ccccc2)[C@@H](Nc2ccc(F)cc2)c2ccc(OCC(=O)OC(C)(C)C)cc2)(c2ccccc2)OC1- InChIKey
FHYFZCNJCWBSBC-INWXZMKZSA-N- Molecular formula
- C43H47FN2O8S
- Average molar mass
- 770.9 g/mol
- Monoisotopic mass
- 770.3037158
Names & identifiers
- Preferred name
- tert-Butyl (4-{(1S,2R)-2-{[(5,5-dimethyl-2-phenyl-1,3-dioxan-2-yl)methyl]thio}-1-[(4-fluorophenyl)amino]-3-oxo-3-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl}phenoxy)acetate
- IUPAC
- tert-butyl 2-[4-[(1S,2R)-2-[(5,5-dimethyl-2-phenyl-1,3-dioxan-2-yl)methylsulfanyl]-1-(4-fluoroanilino)-3-oxo-3-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl]phenoxy]acetate
Names & synonyms
FHYFZCNJCWBSBC-INWXZMKZSA-Ntert-Butyl (4-{(1S,2R)-2-{[(5,5-dimethyl-2-phenyl-1,3-dioxan-2-yl)methyl]thio}-1-[(4-fluorophenyl)amino]-3-oxo-3-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl}phenoxy)acetate
Database identifiers
- PubChem CID
- 86619086
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 15
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 1,260
Related reactions
2 records
Compound notes
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