2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole

C17H12Cl2N2O — CID 10236778

IUPAC2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole
SMILESClc1cccc(-c2oc3ccc(Cl)cc3c2C2=NCCN2)c1
InChIInChI=1S/C17H12Cl2N2O/c18-11-3-1-2-10(8-11)16-15(17-20-6-7-21-17)13-9-12(19)4-5-14(13)22-16/h1-5,8-9H,6-7H2,(H,20,21)
InChIKeyJIMQAFXHSKYXFW-UHFFFAOYSA-N
MW331.20 g/mol
LogP4.76
Rot. Bonds2

About 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole

2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole (PubChem CID 10236778) has the molecular formula C17H12Cl2N2O and a molecular weight of 331.20 g/mol. Its IUPAC name is 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole
PubChem CID10236778
Molecular FormulaC17H12Cl2N2O
Molecular Weight331.20 g/mol
Exact Mass330.03
IUPAC Name2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole
SMILESClc1cccc(-c2oc3ccc(Cl)cc3c2C2=NCCN2)c1
InChIInChI=1S/C17H12Cl2N2O/c18-11-3-1-2-10(8-11)16-15(17-20-6-7-21-17)13-9-12(19)4-5-14(13)22-16/h1-5,8-9H,6-7H2,(H,20,21)
InChIKeyJIMQAFXHSKYXFW-UHFFFAOYSA-N
XLogP4.76
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.20
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzoxazole
CID 119091936
3-(4,5-dihydro-1H-imidazol-2-yl)benzenethiol
CID 45120784
1-(3-chlorophenyl)-3-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]propan-2-one
CID 58137546
2-[4-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]phenyl]phenyl]-4,5-dihydro-1H-imidazole
CID 71747659
5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol
CID 137272912
5-chloro-3-(4,5-dihydro-1H-imidazol-2-yl)-2-thiophen-3-yl-1H-indole
CID 10171780
2-[4-[(3-chlorophenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole
CID 82249999
2-[2-[4-(5-chlorothiophen-2-yl)-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole
CID 54031996
5-chloro-2-(4-chloro-3-methylphenyl)-3-(4,5-dihydro-1H-imidazol-2-yl)-1H-indole
CID 10308852
2-(5-phenyl-2-benzofuran-1-yl)-4,5-dihydro-1H-imidazole;hydrochloride
CID 57447514
1-(2,5-dichlorophenyl)-3-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea
CID 66919885
2-[5-(5-chlorothiophen-2-yl)-2-benzofuran-1-yl]-4,5-dihydro-1H-imidazole
CID 57447507

Frequently Asked Questions

What is the IUPAC name of 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole (CID 10236778) is 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole is Clc1cccc(-c2oc3ccc(Cl)cc3c2C2=NCCN2)c1.
What is the InChIKey of 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole?
The InChIKey is JIMQAFXHSKYXFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O/c18-11-3-1-2-10(8-11)16-15(17-20-6-7-21-17)13-9-12(19)4-5-14(13)22-16/h1-5,8-9H,6-7H2,(H,20,21).
What are the key properties of 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole?
2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole has a molecular weight of 331.20 g/mol, XLogP of 4.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-chloro-2-(3-chlorophenyl)-1-benzofuran-3-yl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 10236778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).