Basic information
- Standard SMILES
CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)N1Cc2cc(N)ccc2C1=O- InChIKey
ZXODZBCWTTZWAV-UHFFFAOYSA-N- Molecular formula
- C21H30N2O5
- Average molar mass
- 390.5 g/mol
Names & identifiers
- Preferred name
- 5-Amino-2-(1,3-bis-(t-butyloxycarbonyl)propyl)isoindolin-1-one
- IUPAC
- ditert-butyl 2-(6-amino-3-oxo-1H-isoindol-2-yl)pentanedioate
Names & synonyms
SCHEMBL9087773ZXODZBCWTTZWAV-UHFFFAOYSA-N5-amino-2-(1,3-bis-(t-butyloxycarbonyl)propyl)isoindolin-1-one
Database identifiers
- PubChem CID
- 22418643
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 98.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 605
Related reactions
2 records
Compound notes
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