2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole

C21H15ClF2N2 — CID 44573448

IUPAC2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole
SMILESFc1ccc(C2(c3ccc(F)cc3)CN=C(c3ccc(Cl)cc3)N2)cc1
InChIInChI=1S/C21H15ClF2N2/c22-17-7-1-14(2-8-17)20-25-13-21(26-20,15-3-9-18(23)10-4-15)16-5-11-19(24)12-6-16/h1-12H,13H2,(H,25,26)
InChIKeyMRMXQLNSYVKKLS-UHFFFAOYSA-N
MW368.81 g/mol
LogP4.91
Rot. Bonds3

About 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole

2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole (PubChem CID 44573448) has the molecular formula C21H15ClF2N2 and a molecular weight of 368.81 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole
PubChem CID44573448
Molecular FormulaC21H15ClF2N2
Molecular Weight368.81 g/mol
Exact Mass368.09
IUPAC Name2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole
SMILESFc1ccc(C2(c3ccc(F)cc3)CN=C(c3ccc(Cl)cc3)N2)cc1
InChIInChI=1S/C21H15ClF2N2/c22-17-7-1-14(2-8-17)20-25-13-21(26-20,15-3-9-18(23)10-4-15)16-5-11-19(24)12-6-16/h1-12H,13H2,(H,25,26)
InChIKeyMRMXQLNSYVKKLS-UHFFFAOYSA-N
XLogP4.91
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.81
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole?
The IUPAC name of 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole (CID 44573448) is 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole.
What is the SMILES notation for 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole?
The canonical SMILES for 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole is Fc1ccc(C2(c3ccc(F)cc3)CN=C(c3ccc(Cl)cc3)N2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole?
The InChIKey is MRMXQLNSYVKKLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClF2N2/c22-17-7-1-14(2-8-17)20-25-13-21(26-20,15-3-9-18(23)10-4-15)16-5-11-19(24)12-6-16/h1-12H,13H2,(H,25,26).
What are the key properties of 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole?
2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole has a molecular weight of 368.81 g/mol, XLogP of 4.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5,5-bis(4-fluorophenyl)-1,4-dihydroimidazole is sourced from PubChem (CID 44573448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).