Basic information
- Standard SMILES
Cc1cccc(C(=O)Nc2cc(-c3ccc4c(c3)OCO4)ccc2C(=O)OC(C)(C)C)c1C- InChIKey
ZSRQIJJXNSYXKX-UHFFFAOYSA-N- Molecular formula
- C27H27NO5
- Average molar mass
- 445.5 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 4-(benzo[1,3]dioxol-5-yl)-2-(2,3-dimethylbenzamido)benzoate
- IUPAC
- tert-butyl 4-(1,3-benzodioxol-5-yl)-2-[(2,3-dimethylbenzoyl)amino]benzoate
Names & synonyms
SCHEMBL2272608ZSRQIJJXNSYXKX-UHFFFAOYSA-Ntert-butyl 4-(benzo[1,3]dioxol-5-yl)-2-(2,3-dimethylbenzamido)benzoate
Database identifiers
- PubChem CID
- 67342913
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 703
Related reactions
4 records
Compound notes
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