5-Bromo-N-[4,5-bis(furan-2-yl)oxazol-2-yl]-2-hydroxybenzamide

HCID 10001872

Notes Reactions

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Basic information

Standard SMILES: O=C(Nc1nc(-c2ccco2)c(-c2ccco2)o1)c1cc(Br)ccc1O
InChIKey: CREVSXRIYCOPPO-UHFFFAOYSA-N
Molecular formula: C18H11BrN2O5
Average molar mass: 415.2 g/mol
Monoisotopic mass: 413.98513

Names & identifiers

Preferred name: 5-Bromo-N-[4,5-bis(furan-2-yl)oxazol-2-yl]-2-hydroxybenzamide
IUPAC: N-[4,5-bis(furan-2-yl)-1,3-oxazol-2-yl]-5-bromo-2-hydroxybenzamide

Names & synonyms

SCHEMBL330328CREVSXRIYCOPPO-UHFFFAOYSA-N5-Bromo-N-[4,5-bis(furan 2-yl)oxazol-2-yl]-2-hydroxybenzamide5-Bromo-N-[4,5-bis(furan-2-yl)oxazol-2-yl]-2-hydroxybenzamide

Database identifiers

PubChem CID: 10001872

Properties

Computed structural properties

XLogP: 3.9
Topological polar surface area: 102 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 4
Heavy atoms: 26
Formal charge: 0
Complexity: 510

Related reactions

4 records

New reaction record

HRID 421033As productuspto-grants-2012_01

HRID 644397As productuspto-grants-2010_04

HRID 2133996As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

HRID 2384336As productuspto-grants-2012_09

Compound notes

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