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Basic information
- CAS
87495-31-6- Standard SMILES
Cc1cc(CCCCCCCOc2ccc(C3=NCCO3)cc2)on1- InChIKey
FKLJPTJMIBLJAV-UHFFFAOYSA-N- Molecular formula
- C20H26N2O3
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.1943427
Names & identifiers
- Preferred name
- Disoxaril
- IUPAC
- 5-[7-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]heptyl]-3-methyl-1,2-oxazole
- English name
- Disoxaril
- Molecular formula
- C20H26N2O3
- Molecular weight
- 342.43
Names & synonyms
DISOXARIL87495-31-6DisoxariloWin-51711DisoxarilumFX8Q9PI4VPWIN 51,7115-(7-(4-(4,5-Dihydro-2-oxazolyl)phenoxy)heptyl)-3-methylisoxazoleDTXSID70236354Isoxazole, 5-(7-(4-(4,5-dihydro-2-oxazolyl)phenoxy)heptyl)-3-methyl-Isoxazole, 5-[7-[4-(4,5-dihydro-2-oxazolyl)phenoxy]heptyl]-3-methyl-5-[7-[4-(4,5-dihydrooxazol-2-yl)phenoxy]heptyl]-3-methyl-isoxazole
Show more names
BRN 3626820BRN-3626820Disoxaril (WIN 517113-Methyl-5-[7-[4-(2-oxazolin-2-yl)phenoxy]heptyl]isoxazole5-[7-[4-(4,5-Dihydrooxazol-2-yl)phenoxy]heptyl]-3-methylisoxazole
5-{7-[4-(4,5-Dihydro-2-oxazolyl)phenoxy]heptyl}-3-methylisoxazole5-(7-(4-(4,5-dihydrooxazol-2-yl)phenoxy)heptyl)-3-methyl-isoxazoleRefChem:530591DTXCID70158845Compound IVDisoxarilum [Latin]WIN 51711Disoxarilo [Spanish]
Database identifiers
- CAS
87495-31-6- PubChem CID
- 55717
- DTXSID
DTXSID70236354- ChEMBL
CHEMBL283639- ChEBI
CHEBI:3846- UNII
- FX8Q9PI4VP
- Nikkaji
- J22.038H
Properties
Computed structural propertiesFilling in
- XLogP
- 4.4
- Topological polar surface area
- 56.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 408
Physicochemical properties
- FDA UNII
- 8 Q9PI4VP · FX8Q9PI4VP
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly.
Applications
Uses.Antiviral.
UsesDisoxaril is used as an anti-viral against human rhinovirus.
Suppliers3 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Additional notes
DefinitionChEBI: Compound IV is an aromatic ether.
Related reactions
10 records
Compound notes
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