(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine

C18H15Cl2N3O2 — CID 22904486

IUPAC(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine
SMILESCO/N=C(/c1ccccc1OCc1ccc(Cl)cc1Cl)n1ccnc1
InChIInChI=1S/C18H15Cl2N3O2/c1-24-22-18(23-9-8-21-12-23)15-4-2-3-5-17(15)25-11-13-6-7-14(19)10-16(13)20/h2-10,12H,11H2,1H3/b22-18-
InChIKeyPXEQGXXATWKODT-PYCFMQQDSA-N
MW376.24 g/mol
LogP4.63
Rot. Bonds5

About (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine

(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine (PubChem CID 22904486) has the molecular formula C18H15Cl2N3O2 and a molecular weight of 376.24 g/mol. Its IUPAC name is (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine.

Molecular Properties

Compound Name(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine
PubChem CID22904486
Molecular FormulaC18H15Cl2N3O2
Molecular Weight376.24 g/mol
Exact Mass375.05
IUPAC Name(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine
SMILESCO/N=C(/c1ccccc1OCc1ccc(Cl)cc1Cl)n1ccnc1
InChIInChI=1S/C18H15Cl2N3O2/c1-24-22-18(23-9-8-21-12-23)15-4-2-3-5-17(15)25-11-13-6-7-14(19)10-16(13)20/h2-10,12H,11H2,1H3/b22-18-
InChIKeyPXEQGXXATWKODT-PYCFMQQDSA-N
XLogP4.63
TPSA48.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.24
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole
CID 3007459
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-[(2,4-dichlorophenyl)methoxy]phenyl]ethyl]imidazole
CID 21481629
bis[2-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-3-imidazol-1-ylprop-1-enyl] oxalate
CID 57052475
1-[(Z)-1-[2-[(3-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
CID 6479458
1-[2-[2-[(2,4-dichlorophenyl)methoxy]phenyl]prop-2-enyl]imidazole;4-methylbenzenesulfonic acid
CID 14062131
1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
CID 3007491
1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]butyl]imidazole;nitric acid
CID 71397350
1-[1-[2-[(2-bromo-4,5-dimethoxyphenyl)methoxy]phenyl]ethenyl]imidazole
CID 24633273
[2-[(2,4-dichlorophenyl)methoxy]phenyl]-(4-hydroxypiperidin-1-yl)methanone
CID 60590462

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine?
The IUPAC name of (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine (CID 22904486) is (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine.
What is the SMILES notation for (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine?
The canonical SMILES for (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine is CO/N=C(/c1ccccc1OCc1ccc(Cl)cc1Cl)n1ccnc1.
What is the InChIKey of (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine?
The InChIKey is PXEQGXXATWKODT-PYCFMQQDSA-N. The full InChI is InChI=1S/C18H15Cl2N3O2/c1-24-22-18(23-9-8-21-12-23)15-4-2-3-5-17(15)25-11-13-6-7-14(19)10-16(13)20/h2-10,12H,11H2,1H3/b22-18-.
What are the key properties of (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine?
(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine has a molecular weight of 376.24 g/mol, XLogP of 4.63, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine is sourced from PubChem (CID 22904486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).