3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole

C19H12F3N3O — CID 25130449

IUPAC3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole
SMILESFC(F)(F)c1onc(-c2ccccc2)c1-c1cn(-c2ccccc2)cn1
InChIInChI=1S/C19H12F3N3O/c20-19(21,22)18-16(17(24-26-18)13-7-3-1-4-8-13)15-11-25(12-23-15)14-9-5-2-6-10-14/h1-12H
InChIKeyGNGKJRWFAFBGGR-UHFFFAOYSA-N
MW355.32 g/mol
LogP5.21
Rot. Bonds3

About 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole

3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole (PubChem CID 25130449) has the molecular formula C19H12F3N3O and a molecular weight of 355.32 g/mol. Its IUPAC name is 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole.

Molecular Properties

Compound Name3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole
PubChem CID25130449
Molecular FormulaC19H12F3N3O
Molecular Weight355.32 g/mol
Exact Mass355.09
IUPAC Name3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole
SMILESFC(F)(F)c1onc(-c2ccccc2)c1-c1cn(-c2ccccc2)cn1
InChIInChI=1S/C19H12F3N3O/c20-19(21,22)18-16(17(24-26-18)13-7-3-1-4-8-13)15-11-25(12-23-15)14-9-5-2-6-10-14/h1-12H
InChIKeyGNGKJRWFAFBGGR-UHFFFAOYSA-N
XLogP5.21
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.32
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenyl-5-(trifluoromethyl)-4-[1-[4-(trifluoromethyl)phenyl]imidazol-4-yl]-1,2-oxazole
CID 25130781
3-(4-chlorophenyl)-5-(trifluoromethyl)-4-[1-[4-(trifluoromethyl)phenyl]imidazol-4-yl]-1,2-oxazole
CID 25132120
6-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]pyridine-3-carboxylic acid
CID 67364083
5-methyl-3-phenyl-4-[1-[4-(trifluoromethyl)phenyl]imidazol-4-yl]-1,2-oxazole
CID 23725748
3-(4-fluorophenyl)-5-methyl-4-[1-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-1,2-oxazole
CID 23725803
4-[1-(3,4-dichlorophenyl)imidazol-4-yl]-5-methyl-3-phenyl-1,2-oxazole
CID 23725269
[4-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)imidazol-1-yl]phenyl]carbamic acid
CID 67422146
5-methyl-3-phenyl-4-(1-pyrimidin-2-ylimidazol-4-yl)-1,2-oxazole
CID 23725963
4-[4-[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]imidazol-1-yl]benzoic acid
CID 67419925
4-methyl-3-phenyl-5-(trifluoromethyl)-1,2-oxazole
CID 10263127
3-(4-fluorophenyl)-5-methyl-4-(1-pyridin-3-ylimidazol-4-yl)-1,2-oxazole
CID 23725201
4-(4-phenylimidazol-1-yl)benzoic acid
CID 58156765

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole?
The IUPAC name of 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole (CID 25130449) is 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole.
What is the SMILES notation for 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole?
The canonical SMILES for 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole is FC(F)(F)c1onc(-c2ccccc2)c1-c1cn(-c2ccccc2)cn1.
What is the InChIKey of 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole?
The InChIKey is GNGKJRWFAFBGGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3N3O/c20-19(21,22)18-16(17(24-26-18)13-7-3-1-4-8-13)15-11-25(12-23-15)14-9-5-2-6-10-14/h1-12H.
What are the key properties of 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole?
3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole has a molecular weight of 355.32 g/mol, XLogP of 5.21, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-4-(1-phenylimidazol-4-yl)-5-(trifluoromethyl)-1,2-oxazole is sourced from PubChem (CID 25130449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).