Basic information
- Standard SMILES
C=CC[C@H]1C[C@H](NC(=O)OCc2ccccc2)C[C@@]1(NC(C)=O)C(=O)NC(C)(C)C- InChIKey
BMFDOUBONBXNRU-YDHSSHFGSA-N- Molecular formula
- C23H33N3O4
- Average molar mass
- 415.5 g/mol
Names & identifiers
- Preferred name
- benzyl (1S,3S,4S)-3-acetamido-4-allyl-3-(tert-butylcarbamoyl)cyclopentylcarbamate
- IUPAC
- benzyl N-[(1S,3S,4S)-3-acetamido-3-(tert-butylcarbamoyl)-4-prop-2-enylcyclopentyl]carbamate
Names & synonyms
SCHEMBL28396484BMFDOUBONBXNRU-YDHSSHFGSA-Nbenzyl (1S,3S,4S)-3-acetamido-4-allyl-3-(tert-butylcarbamoyl)cyclopentylcarbamate
Database identifiers
- PubChem CID
- 86665797
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 637
Related reactions
1 records
Compound notes
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