N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-3-iodobenzamide
Basic information
- CAS
313667-48-0- Standard SMILES
O=C(Nc1ccc2oc(-c3cccc(Br)c3)nc2c1)c1cccc(I)c1- InChIKey
HOQNNAUQXGLBOG-UHFFFAOYSA-N- Molecular formula
- C20H12BrIN2O2
- Average molar mass
- 519.1 g/mol
- Monoisotopic mass
- 517.91269
Names & identifiers
- Preferred name
- N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-3-iodobenzamide
- IUPAC
- N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-3-iodobenzamide
Names & synonyms
N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-3-iodobenzamide313667-48-0N-[2-(3-Bromophenyl)-5-benzoxazolyl]-3-iodobenzamideOprea1_297793DTXSID501218843MFCD00807015AKOS001484552EU-0034546SR-01000397844SR-01000397844-1
Database identifiers
- CAS
313667-48-0- PubChem CID
- 2185362
- DTXSID
DTXSID501218843
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 508
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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