2-[2-Chloro-5-(5-phenylbenzoxazol-2-yl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

HCID 21884599
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Basic information

Standard SMILES
O=C(O)c1ccc2c(c1)C(=O)N(c1cc(-c3nc4cc(-c5ccccc5)ccc4o3)ccc1Cl)C2=O
InChIKey
UMFYKPILIDDLAA-UHFFFAOYSA-N
Molecular formula
C28H15ClN2O5
Average molar mass
494.9 g/mol

Names & identifiers

Preferred name
2-[2-Chloro-5-(5-phenylbenzoxazol-2-yl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
IUPAC
2-[2-chloro-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]-1,3-dioxoisoindole-5-carboxylic acid

Names & synonyms

SCHEMBL5835603UMFYKPILIDDLAA-UHFFFAOYSA-N2-[2-Chloro-5-(5-phenylbenzoxazol-2-yl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

Database identifiers

PubChem CID
21884599

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
101 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
36

Related reactions

2 records
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Compound notes

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