3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole

C23H15F2N3 — CID 139758003

IUPAC3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole
SMILESFc1ccc(-c2nc(-c3ccc(F)cc3)c(-c3c[nH]c4ccccc34)[nH]2)cc1
InChIInChI=1S/C23H15F2N3/c24-16-9-5-14(6-10-16)21-22(19-13-26-20-4-2-1-3-18(19)20)28-23(27-21)15-7-11-17(25)12-8-15/h1-13,26H,(H,27,28)
InChIKeyDIZQOQVEKRFMRQ-UHFFFAOYSA-N
MW371.39 g/mol
LogP6.17
Rot. Bonds3

About 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole

3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole (PubChem CID 139758003) has the molecular formula C23H15F2N3 and a molecular weight of 371.39 g/mol. Its IUPAC name is 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole.

Molecular Properties

Compound Name3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole
PubChem CID139758003
Molecular FormulaC23H15F2N3
Molecular Weight371.39 g/mol
Exact Mass371.12
IUPAC Name3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole
SMILESFc1ccc(-c2nc(-c3ccc(F)cc3)c(-c3c[nH]c4ccccc34)[nH]2)cc1
InChIInChI=1S/C23H15F2N3/c24-16-9-5-14(6-10-16)21-22(19-13-26-20-4-2-1-3-18(19)20)28-23(27-21)15-7-11-17(25)12-8-15/h1-13,26H,(H,27,28)
InChIKeyDIZQOQVEKRFMRQ-UHFFFAOYSA-N
XLogP6.17
TPSA44.47 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.39
LogP ≤ 56.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-[2-(2,4-difluorophenyl)-4-(4-methoxyphenyl)-1H-imidazol-5-yl]-1H-indole
CID 139757971
3-[2-[4-(difluoromethoxy)phenyl]-4-(4-methoxyphenyl)-1H-imidazol-5-yl]-1H-indole
CID 139927237
3-[5-(4-phenoxyphenyl)-4-phenyl-1H-imidazol-2-yl]-1H-indole
CID 4207500
3-[4-(4-methoxyphenyl)-2-[3-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]-1H-indole
CID 139927242
3-(4-phenyl-1H-imidazol-5-yl)-1H-indole
CID 141454791
3-[5-(4-nitrophenyl)-4-phenyl-1H-imidazol-2-yl]-1H-indole
CID 3106829
3-[4-[7-[2-(1H-indol-3-yl)-4-phenyl-1H-imidazol-5-yl]dibenzofuran-3-yl]-5-phenyl-1H-imidazol-2-yl]-1H-indole
CID 135407484
2-[4,5-bis(4-fluorophenyl)-1H-imidazol-2-yl]-4,5-bis(4-fluorophenyl)-1H-imidazole
CID 68616974
5-(4-fluorophenyl)-4-(1H-indol-3-yl)pyrimidin-2-amine
CID 101432469
3-[4-(1H-indol-3-yl)phenyl]-1H-indole
CID 175007681
2-[5-(1H-indol-3-yl)-3-phenyl-1H-pyrazol-4-yl]-1H-benzimidazole
CID 2373893
2-[4,5-bis(4-fluorophenyl)-1H-imidazol-2-yl]phenol
CID 135755905

Frequently Asked Questions

What is the IUPAC name of 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole?
The IUPAC name of 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole (CID 139758003) is 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole.
What is the SMILES notation for 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole?
The canonical SMILES for 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole is Fc1ccc(-c2nc(-c3ccc(F)cc3)c(-c3c[nH]c4ccccc34)[nH]2)cc1.
What is the InChIKey of 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole?
The InChIKey is DIZQOQVEKRFMRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15F2N3/c24-16-9-5-14(6-10-16)21-22(19-13-26-20-4-2-1-3-18(19)20)28-23(27-21)15-7-11-17(25)12-8-15/h1-13,26H,(H,27,28).
What are the key properties of 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole?
3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole has a molecular weight of 371.39 g/mol, XLogP of 6.17, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2,4-bis(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indole is sourced from PubChem (CID 139758003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).