Basic information
- CAS
352519-40-5- Standard SMILES
Cc1ccc2oc(-c3cc(NC(=O)c4cccc(Br)c4)ccc3Cl)nc2c1- InChIKey
IJQZOQKNULYTIY-UHFFFAOYSA-N- Molecular formula
- C21H14BrClN2O2
- Average molar mass
- 441.7 g/mol
- Monoisotopic mass
- 439.99272
Names & identifiers
- Preferred name
- 3-bromo-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
- IUPAC
- 3-bromo-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
- English name
- 3-bromo-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
- Molecular formula
- C21H14BrClN2O2
- Molecular weight
- 441.70506
Names & synonyms
3-bromo-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamideOprea1_745037AG-690/34446011
Database identifiers
- CAS
352519-40-5- PubChem CID
- 7032399
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 536
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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