1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole

C18H14Cl2N2O — CID 3007459

IUPAC1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole
SMILESC=C(c1ccccc1OCc1ccc(Cl)cc1Cl)n1ccnc1
InChIInChI=1S/C18H14Cl2N2O/c1-13(22-9-8-21-12-22)16-4-2-3-5-18(16)23-11-14-6-7-15(19)10-17(14)20/h2-10,12H,1,11H2
InChIKeyWSJCEFBEHAVGML-UHFFFAOYSA-N
MW345.23 g/mol
LogP5.29
Rot. Bonds5

About 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole

1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole (PubChem CID 3007459) has the molecular formula C18H14Cl2N2O and a molecular weight of 345.23 g/mol. Its IUPAC name is 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole.

Molecular Properties

Compound Name1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole
PubChem CID3007459
Molecular FormulaC18H14Cl2N2O
Molecular Weight345.23 g/mol
Exact Mass344.05
IUPAC Name1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole
SMILESC=C(c1ccccc1OCc1ccc(Cl)cc1Cl)n1ccnc1
InChIInChI=1S/C18H14Cl2N2O/c1-13(22-9-8-21-12-22)16-4-2-3-5-18(16)23-11-14-6-7-15(19)10-17(14)20/h2-10,12H,1,11H2
InChIKeyWSJCEFBEHAVGML-UHFFFAOYSA-N
XLogP5.29
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.23
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine
CID 22904486
1-[(Z)-1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
CID 6479456
1-[1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
CID 3007496
1-[2-[2-[(2,4-dichlorophenyl)methoxy]phenyl]prop-2-enyl]imidazole;sulfuric acid
CID 14062132
1-[1-[2-[(2-bromo-4,5-dimethoxyphenyl)methoxy]phenyl]ethenyl]imidazole
CID 24633273
1-[1-[2-[3-(4-chlorophenyl)sulfanylpropoxy]phenyl]ethenyl]imidazole
CID 3007472
N-(4-chlorophenyl)-2-[2-(1-imidazol-1-ylethenyl)phenoxy]acetamide
CID 24592038
N-(3-chlorophenyl)-2-[2-(1-imidazol-1-ylethenyl)phenoxy]acetamide
CID 24592032
N-(4-chloro-2-methylphenyl)-2-[2-(1-imidazol-1-ylethenyl)phenoxy]acetamide
CID 24633242
bis[2-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-3-imidazol-1-ylprop-1-enyl] oxalate
CID 57052475
1-[2-[2-[(2,4-dichlorophenyl)methoxy]phenyl]prop-2-enyl]imidazole;4-methylbenzenesulfonic acid
CID 14062131
1-[1-(2-methoxyphenyl)ethenyl]imidazole
CID 3007441

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole?
The IUPAC name of 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole (CID 3007459) is 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole.
What is the SMILES notation for 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole?
The canonical SMILES for 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole is C=C(c1ccccc1OCc1ccc(Cl)cc1Cl)n1ccnc1.
What is the InChIKey of 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole?
The InChIKey is WSJCEFBEHAVGML-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2O/c1-13(22-9-8-21-12-22)16-4-2-3-5-18(16)23-11-14-6-7-15(19)10-17(14)20/h2-10,12H,1,11H2.
What are the key properties of 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole?
1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole has a molecular weight of 345.23 g/mol, XLogP of 5.29, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole is sourced from PubChem (CID 3007459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).