tert-Butyl cyclopentyl{4-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]phenyl}acetate
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Basic information
- Standard SMILES
CC(C)(C)OC(=O)C(c1ccc(CN2C(=O)c3ccccc3C2=O)cc1)C1CCCC1- InChIKey
ZSIIWDSQJMVCPD-UHFFFAOYSA-N- Molecular formula
- C26H29NO4
- Average molar mass
- 419.5 g/mol
Names & identifiers
- Preferred name
- tert-Butyl cyclopentyl{4-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]phenyl}acetate
- IUPAC
- tert-butyl 2-cyclopentyl-2-[4-[(1,3-dioxoisoindol-2-yl)methyl]phenyl]acetate
Names & synonyms
SCHEMBL1178645ZSIIWDSQJMVCPD-UHFFFAOYSA-Ntert-Butyl cyclopentyl{4-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]phenyl}acetatetert-butyl(+/-)-2-cyclopentyl-2-(4-((1,3-dioxoisoindolin-2-yl)methyl)-phenyl)acetate
Database identifiers
- PubChem CID
- 58136372
Properties
Computed structural propertiesFilling in
- XLogP
- 5.4
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 658
Related reactions
2 records
Compound notes
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