Basic information
- Standard SMILES
CN(C)C(=O)Oc1ccc(-c2cc3cc(CN4CCCCC4)ccc3n2C(=O)OC(C)(C)C)c2c1CNC2=O- InChIKey
VNZILVNLOFSREM-UHFFFAOYSA-N- Molecular formula
- C30H36N4O5
- Average molar mass
- 532.6 g/mol
Names & identifiers
- Preferred name
- 4-Dimethylcarbamoyloxy-7-[1-(tert-butoxycarbonyl)-5-(piperidinomethyl)indol-2-yl]isoindolinone
- IUPAC
- tert-butyl 2-[7-(dimethylcarbamoyloxy)-3-oxo-1,2-dihydroisoindol-4-yl]-5-(piperidin-1-ylmethyl)indole-1-carboxylate
Names & synonyms
SCHEMBL3044271VNZILVNLOFSREM-UHFFFAOYSA-N4-dimethylcarbamoyloxy-7-[1-(tert-butoxycarbonyl)-5-(piperidinomethyl)indol-2-yl]isoindolinone
Database identifiers
- PubChem CID
- 68490997
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 93.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 914
Related reactions
1 records
Compound notes
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