Basic information
- Standard SMILES
Cc1cc(OCc2ccccc2)c(C(=O)Nc2cccnc2)cc1Br- InChIKey
VXPAEGIGRDIXNY-UHFFFAOYSA-N- Molecular formula
- C20H17BrN2O2
- Average molar mass
- 397.3 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-4-methyl-2-[(phenylmethyl)oxy]-N-3-pyridinylbenzamide
- IUPAC
- 5-bromo-4-methyl-2-phenylmethoxy-N-pyridin-3-ylbenzamide
Names & synonyms
SCHEMBL166020VXPAEGIGRDIXNY-UHFFFAOYSA-N5-Bromo-4-methyl-2-[(phenylmethyl)oxy]-N-3-pyridinylbenzamide5-Bromo-4-methyl-2-[(phenylmethyl)oxy]-N-3-pyridinyl benzamide
Database identifiers
- PubChem CID
- 66611237
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 428
Related reactions
2 records
Compound notes
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