Basic information
- Standard SMILES
CC(C)(C)OC(=O)[C@@H](N)Cc1cn(C(=O)OC(C)(C)C)c2ccccc12- InChIKey
HUJOZLUMSHQHDO-HNNXBMFYSA-N- Molecular formula
- C20H28N2O4
- Average molar mass
- 360.4 g/mol
Names & identifiers
- Preferred name
- tert-butyl 3-[(2S)-2-amino-3-(tert-butoxy)-3-oxopropyl]-1H-indole-1-carboxylate
- IUPAC
- tert-butyl 3-[(2S)-2-amino-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]indole-1-carboxylate
Names & synonyms
tert-butyl 3-[(2S)-2-amino-3-(tert-butoxy)-3-oxopropyl]-1H-indole-1-carboxylate252187-12-5SCHEMBL487202SCHEMBL29918287HUJOZLUMSHQHDO-HNNXBMFYSA-NEN300-28299835(S)-3-(2-Amino-2-tert-butoxycarbonyl-ethyl)-indole-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 7021141
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 521
Related reactions
1 records
Compound notes
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