Basic information
- CAS
66778-37-8- Standard SMILES
Clc1ccc(C(Cn2ccnc2)OCc2c(Cl)cccc2Cl)cc1- InChIKey
PBNSEYNKZBMLLY-UHFFFAOYSA-N- Molecular formula
- C18H15Cl3N2O
- Average molar mass
- 381.7 g/mol
- Monoisotopic mass
- 380.024996
Names & identifiers
- Preferred name
- 1-[2-(4-Chlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]imidazole
- IUPAC
- 1-[2-(4-chlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]imidazole
- English name
- Orconazole
- Molecular formula
- C18H15Cl3N2O
- Molecular weight
- 381.689
Names & synonyms
1-[2-(4-chlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]imidazoleSCHEMBL1257781CHEMBL2110698DTXSID50867246Q272521561-{2-(4-Chlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl}-1H-imidazole(+/-)-1(P-CHLORO-.BETA.-((2,6-DICHLOROBENZYL)OXY)PHENETHYL)IMIDAZOLEOrconazoleOrconazole [inn]
Database identifiers
- CAS
66778-37-8- PubChem CID
- 167461
- DTXSID
DTXSID50867246- ChEMBL
CHEMBL2110698- UNII
- 1AEW4KBV9O
- Nikkaji
- J1.095.035J
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 369
Physicochemical properties
- FDA UNII
- 1 AEW4KBV9O · 1AEW4KBV9O
Chemistry & industry
Applications
UsesAntifungal.
Suppliers1 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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