4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole

C21H15Cl2FN2 — CID 10309456

IUPAC4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole
SMILESFc1cccc(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2)c1
InChIInChI=1S/C21H15Cl2FN2/c22-16-8-4-13(5-9-16)19-20(14-6-10-17(23)11-7-14)26-21(25-19)15-2-1-3-18(24)12-15/h1-12,19-20H,(H,25,26)
InChIKeyLOSZETUJMHMDBD-UHFFFAOYSA-N
MW385.27 g/mol
LogP5.96
Rot. Bonds3

About 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole

4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole (PubChem CID 10309456) has the molecular formula C21H15Cl2FN2 and a molecular weight of 385.27 g/mol. Its IUPAC name is 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole
PubChem CID10309456
Molecular FormulaC21H15Cl2FN2
Molecular Weight385.27 g/mol
Exact Mass384.06
IUPAC Name4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole
SMILESFc1cccc(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2)c1
InChIInChI=1S/C21H15Cl2FN2/c22-16-8-4-13(5-9-16)19-20(14-6-10-17(23)11-7-14)26-21(25-19)15-2-1-3-18(24)12-15/h1-12,19-20H,(H,25,26)
InChIKeyLOSZETUJMHMDBD-UHFFFAOYSA-N
XLogP5.96
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.27
LogP ≤ 55.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-4,5-dihydro-1H-imidazole
CID 279088
2,4,5-Triphenyl-2-imidazoline
CID 101777
2-(4-chlorophenyl)-4,5-dihydro-1H-imidazole hydrochloride
CID 2945131
2-(3-chlorophenyl)-4,4-bis(4-fluorophenyl)-4,5-dihydro-1H-imidazole
CID 9947469
(4R,5S)-2-[(2-fluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 11209712
(4R,5S)-2-[2-(2-fluorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 11416652
(4R,5S)-2-[(2,3-difluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 11462177
(4R,5S)-2-[2-(3-fluorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388772
(4R,5S)-2-[2-(4-fluorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388773
(4R,5S)-2-[2-(2-chlorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388794
(4R,5S)-2-[2-(3-chlorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388802
(4R,5S)-2-[(3-fluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388973

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole (CID 10309456) is 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole is Fc1cccc(C2=NC(c3ccc(Cl)cc3)C(c3ccc(Cl)cc3)N2)c1.
What is the InChIKey of 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole?
The InChIKey is LOSZETUJMHMDBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15Cl2FN2/c22-16-8-4-13(5-9-16)19-20(14-6-10-17(23)11-7-14)26-21(25-19)15-2-1-3-18(24)12-15/h1-12,19-20H,(H,25,26).
What are the key properties of 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole?
4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole has a molecular weight of 385.27 g/mol, XLogP of 5.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(4-chlorophenyl)-2-(3-fluorophenyl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 10309456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).