Basic information
- Standard SMILES
Cc1ccc(NC(=O)c2cccc(C(C)(C)C)c2)cc1Br- InChIKey
GZJHSGVJXAHCTH-UHFFFAOYSA-N- Molecular formula
- C18H20BrNO
- Average molar mass
- 346.3 g/mol
Names & identifiers
- Preferred name
- N-(3-Bromo-4-methylphenyl)-3-tert-butylbenzamide
- IUPAC
- N-(3-bromo-4-methylphenyl)-3-tert-butylbenzamide
Names & synonyms
SCHEMBL15122844GZJHSGVJXAHCTH-UHFFFAOYSA-NN-(3-Bromo-4-methylphenyl)-3-tert-butylbenzamide
Database identifiers
- PubChem CID
- 86690964
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 363
Related reactions
2 records
Compound notes
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