N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-3-bromo-4-ethoxybenzamide
Basic information
- CAS
5764-27-2- Standard SMILES
CCOc1ccc(C(=O)Nc2cc(-c3nc4ccccc4o3)ccc2OC)cc1Br- InChIKey
MRURPUIMOHQSKL-UHFFFAOYSA-N- Molecular formula
- C23H19BrN2O4
- Average molar mass
- 467.3 g/mol
- Monoisotopic mass
- 466.05282
Names & identifiers
- Preferred name
- N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-3-bromo-4-ethoxybenzamide
- IUPAC
- N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-3-bromo-4-ethoxybenzamide
Names & synonyms
5764-27-2N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-3-bromo-4-ethoxybenzamideZINC1210200STK240447CBMicro_032703Oprea1_606723DTXSID20362233MFCD01144523ZINC01210200AKOS000463236BIM-0032813.P001ZINC000001210200
Show more names
N(5(13benzoxazol2yl)2methoxyphenyl)3bromo4ethoxybenzamideCCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)OC)Br
Database identifiers
- CAS
5764-27-2- PubChem CID
- 1365610
- DTXSID
DTXSID20362233
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 579
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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