N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-iodobenzamide
Basic information
- CAS
5797-00-2- Standard SMILES
Cc1cc2nc(-c3ccc(C)c(NC(=O)c4ccccc4I)c3)oc2cc1C- InChIKey
CRCDPWWXOLZONY-UHFFFAOYSA-N- Molecular formula
- C23H19IN2O2
- Average molar mass
- 482.3 g/mol
- Monoisotopic mass
- 482.04913
Names & identifiers
- Preferred name
- N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-iodobenzamide
- IUPAC
- N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-iodobenzamide
Names & synonyms
5797-00-2N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-iodobenzamideN-[5-(5,6-DIMETHYLBENZO[D]OXAZOL-2-YL)-2-METHYL-PHENYL]-2-IODO-BENZAMIDEOprea1_574504DTXSID60367540
Database identifiers
- CAS
5797-00-2- PubChem CID
- 2273530
- DTXSID
DTXSID60367540
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 559
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Compound notes
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