Benzamide, N-(3-(((4-bromophenyl)amino)methyl)-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-1-azetidinyl)-2-hydroxy-
Basic information
- CAS
87444-01-7- Standard SMILES
COc1ccc(C2N(NC(=O)c3ccccc3O)C(=O)C2(Cl)CNc2ccc(Br)cc2)cc1O- InChIKey
FSSASFIRTVQVTG-UHFFFAOYSA-N- Molecular formula
- C24H21BrClN3O5
- Average molar mass
- 546.8 g/mol
- Monoisotopic mass
- 545.03531
Names & identifiers
- Preferred name
- Benzamide, N-(3-(((4-bromophenyl)amino)methyl)-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-1-azetidinyl)-2-hydroxy-
- IUPAC
- N-[3-[(4-bromoanilino)methyl]-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxoazetidin-1-yl]-2-hydroxybenzamide
Names & synonyms
87444-01-7Benzamide, N-(3-(((4-bromophenyl)amino)methyl)-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-1-azetidinyl)-2-hydroxy-RefChem:322278DTXSID501007565N-{3-[(4-Bromoanilino)methyl]-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxoazetidin-1-yl}-2-hydroxybenzene-1-carboximidic acid
Database identifiers
- CAS
87444-01-7- PubChem CID
- 55713
- DTXSID
DTXSID501007565
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 739
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Compound notes
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