4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
Basic information
- CAS
87468-02-8- Standard SMILES
Cc1cc(=O)oc2cc(OC(=O)c3ccco3)ccc12- InChIKey
WVAYNWNBGPUATF-UHFFFAOYSA-N- Molecular formula
- C15H10O5
- Average molar mass
- 270.24 g/mol
- Monoisotopic mass
- 270.05282342
Overview
(4-Methyl-2-oxochromen-7-yl) furan-2-carboxylate is a member of coumarins. It has a role as an anticoronaviral agent.
Names & identifiers
- Preferred name
- 4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
- IUPAC
- (4-methyl-2-oxochromen-7-yl) furan-2-carboxylate
- English name
- AURORA 2961
- Molecular formula
- C15H10O5
- Molecular weight
- 270.24
Names & synonyms
87468-02-84-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate(4-methyl-2-oxochromen-7-yl) furan-2-carboxylateMLS0007127582-Furancarboxylic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl esterSMR0002825254-methyl-2-oxo-2H-chromen-7-yl 2-furoate4-Methyl-2-oxo-2H-1-benzopyran-7-yl furan-2-carboxylateChemDiv2_000087Oprea1_667731Oprea1_783928CBDivE_012489
Show more names
AURORA 2961FURAN-2-CARBOXYLIC ACID 4-METHYL-2-OXO-2H-CHROMEN-7-YL ESTER
cid_728528CHEMBL1327635SCHEMBL25054015BDBM32909DTXSID60352517CHEBI:149799HMS1369D21HMS2681I03
Database identifiers
- CAS
87468-02-8- PubChem CID
- 728528
- DTXSID
DTXSID60352517- ChEMBL
CHEMBL1327635- ChEBI
CHEBI:149799
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 442
Chemistry & industry
Additional notes
DefinitionChEBI: (4-Methyl-2-oxochromen-7-yl) furan-2-carboxylate is a member of coumarins. It has a role as an anticoronaviral agent.
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Compound notes
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