Basic information
- Standard SMILES
CCCO[C@@H]1C[C@H]([C@@H](O[Si](C)(C)C(C)(C)C)[C@H](Cc2cc(F)cc(F)c2)NC(=O)c2cc(Br)cc(C(=O)OC)c2)N(C(=O)OC(C)(C)C)C1- InChIKey
DZIAYACLTRHCPJ-ITGKQZKFSA-N- Molecular formula
- C36H51BrF2N2O7Si
- Average molar mass
- 769.8 g/mol
- Monoisotopic mass
- 768.2617
Names & identifiers
- Preferred name
- (2R,4R)-tert-butyl 2-((1S,2S)-2-(3-bromo-5-(methoxycarbonyl)benzamido)-1-(tert-butyldimethylsilyloxy)-3-(3,5-difluorophenyl)propyl)-4-propoxypyrrolidine-1-carboxylate
- IUPAC
- tert-butyl (2R,4R)-2-[(1S,2S)-2-[(3-bromo-5-methoxycarbonylbenzoyl)amino]-1-[tert-butyl(dimethyl)silyl]oxy-3-(3,5-difluorophenyl)propyl]-4-propoxypyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL2203323DZIAYACLTRHCPJ-ITGKQZKFSA-N(2R,4R)-tert-butyl 2-((1S,2S)-2-(3-bromo-5-(methoxycarbonyl)benzamido)-1-(tert-butyldimethylsilyloxy)-3-(3,5-difluorophenyl)propyl)-4-propoxypyrrolidine-1-carboxylate
Database identifiers
- PubChem CID
- 67315749
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 16
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 1,110
Related reactions
8 records
Compound notes
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