5-methyl-3-phenyl-6-(p-tolyl)-isoxazolo[4,5-c]pyridin-4(5H)-one

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Basic information

Standard SMILES: Cc1ccc(-c2cc3onc(-c4ccccc4)c3c(=O)n2C)cc1
InChIKey: BESWQYUOFDGBAT-UHFFFAOYSA-N
Molecular formula: C20H16N2O2
Average molar mass: 316.4 g/mol
Monoisotopic mass: 316.12117776

Names & identifiers

Preferred name: 5-methyl-3-phenyl-6-(p-tolyl)-isoxazolo[4,5-c]pyridin-4(5H)-one
IUPAC: 5-methyl-6-(4-methylphenyl)-3-phenyl-[1,2]oxazolo[4,5-c]pyridin-4-one

Names & synonyms

CHEMBL5958255-methyl-3-phenyl-6-(p-tolyl)-isoxazolo[4,5-c]pyridin-4(5H)-one5-methyl-3-phenyl-6-p-tolylisoxazolo[4,5-c]pyridin-4(5H)-oneMLS002153019SCHEMBL2482092BESWQYUOFDGBAT-UHFFFAOYSA-NHMS2206F21HMS3358C15BDBM5030586860986-84-7SMR001229081DB-333112

Show more names

5-methyl-3-phenyl-6-(p-tolyl)-isoxazolo [4,5-c]pyridin-4(5H)-one

Database identifiers

PubChem CID: 22015567
ChEMBL: CHEMBL595825

Properties

Computed structural properties

XLogP: 3.7
Topological polar surface area: 46.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 24
Formal charge: 0
Complexity: 504

Related reactions

2 records

New reaction record

HRID 2072199As productuspto-grants-1977_09

HRID 2083788As productuspto-grants-1978_04

Compound notes

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