Basic information
- CAS
41473-09-0- Standard SMILES
Clc1ccc(OCC2=NCCN2)cc1Cl- InChIKey
FVHAONUKSUFJKN-UHFFFAOYSA-N- Molecular formula
- C10H10Cl2N2O
- Average molar mass
- 245.1 g/mol
- Monoisotopic mass
- 244.0170183
Overview
Fenmetozole is a small molecule drug. Fenmetozole has a monoisotopic molecular weight of 244.02 Da.
Names & identifiers
- Preferred name
- Fenmetozole
- IUPAC
- 2-[(3,4-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazole
- English name
- Fenmetozole
- Molecular formula
- C10H10Cl2N2O
- Molecular weight
- 245.11
Names & synonyms
FENMETOZOLE41473-09-02-[(3,4-dichlorophenoxy)methyl]-4,5-dihydro-1H-imidazoleFenmetozolFenmetozole [INN]C15WFN6GMOFenmetozolum1H-Imidazole, 2-((3,4-dichlorophenoxy)methyl)-4,5-dihydro-UNII-C15WFN6GMOFenmetozol [INN-Spanish]Fenmetozolum [INN-Latin]CHEMBL50472
Show more names
2-[(3,4-Dichlorophenoxy)methyl]-2-imidazoline
SCHEMBL635495orb1703452SCHEMBL30295426DTXSID40194371GLXC-06512DH 524AKOS022217777NCGC00408857-01
Database identifiers
- CAS
41473-09-0- PubChem CID
- 32049
- DTXSID
DTXSID40194371- ChEMBL
CHEMBL50472- UNII
- C15WFN6GMO
- Nikkaji
- J16.528J
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Boiling point
- 430 · 430.0±35.0 °C(Predicted)
- Density
- 1.43 · 1.43±0.1 g/cm3(Predicted)
- pka
- 9.63 · 9.63±0.40(Predicted)
- FDA UNII
- 15 WFN6GMO · C15WFN6GMO
Chemistry & industry
Applications
UsesAntidepressant; antagonist (to narcotics).
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
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]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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