3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole

C109H91F4N5O7S — CID 159791549

About 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole

3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole (PubChem CID 159791549) has the molecular formula C109H91F4N5O7S and a molecular weight of 1691.01 g/mol. Its IUPAC name is 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole.

Molecular Properties

• Compound Name: 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole
• PubChem CID: 159791549
• Molecular Formula: C109H91F4N5O7S
• Molecular Weight: 1691.01 g/mol
• Exact Mass: 1689.66
• IUPAC Name: 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole
• SMILES: CC(=O)c1cccn2c(-c3ccc(F)cc3)c(-c3ccc(C)cc3)nc12.Cc1ccc(-c2sc3nncn3c2-c2ccccc2)cc1.Cc1ccc(C2=C(c3ccc(F)c(F)c3)COC2)cc1.Cc1ccc(C2=C(c3cccc(F)c3)C(=O)OC2(C)C)cc1.Cc1ccc(C2=C(c3ccccc3)C(=O)OC2)cc1.Cc1ccc(C2=C(c3ccccc3)COC2)cc1
• InChI: InChI=1S/C22H17FN2O.C19H17FO2.C17H14F2O.C17H13N3S.C17H14O2.C17H16O/c1-14-5-7-16(8-6-14)20-21(17-9-11-18(23)12-10-17)25-13-3-4-19(15(2)26)22(25)24-20;1-12-7-9-13(10-8-12)17-16(18(21)22-19(17,2)3)14-5-4-6-15(20)11-14;1-11-2-4-12(5-3-11)14-9-20-10-15(14)13-6-7-16(18)17(19)8-13;1-12-7-9-14(10-8-12)16-15(13-5-3-2-4-6-13)20-11-18-19-17(20)21-16;1-12-7-9-13(10-8-12)15-11-19-17(18)16(15)14-5-3-2-4-6-14;1-13-7-9-15(10-8-13)17-12-18-11-16(17)14-5-3-2-4-6-14/h3-13H,1-2H3;4-11H,1-3H3;2-8H,9-10H2,1H3;2-11H,1H3;2-10H,11H2,1H3;2-10H,11-12H2,1H3
• InChIKey: NIPVGTUGDJKNLS-UHFFFAOYSA-N
• XLogP: 25.74
• TPSA: 135.62 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 13
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1691.01
LogP ≤ 5	25.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'stilbene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole?

The IUPAC name of 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole (CID 159791549) is 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole.

What is the SMILES notation for 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole?

The canonical SMILES for 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole is CC(=O)c1cccn2c(-c3ccc(F)cc3)c(-c3ccc(C)cc3)nc12.Cc1ccc(-c2sc3nncn3c2-c2ccccc2)cc1.Cc1ccc(C2=C(c3ccc(F)c(F)c3)COC2)cc1.Cc1ccc(C2=C(c3cccc(F)c3)C(=O)OC2(C)C)cc1.Cc1ccc(C2=C(c3ccccc3)C(=O)OC2)cc1.Cc1ccc(C2=C(c3ccccc3)COC2)cc1.

What is the InChIKey of 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole?

The InChIKey is NIPVGTUGDJKNLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17FN2O.C19H17FO2.C17H14F2O.C17H13N3S.C17H14O2.C17H16O/c1-14-5-7-16(8-6-14)20-21(17-9-11-18(23)12-10-17)25-13-3-4-19(15(2)26)22(25)24-20;1-12-7-9-13(10-8-12)17-16(18(21)22-19(17,2)3)14-5-4-6-15(20)11-14;1-11-2-4-12(5-3-11)14-9-20-10-15(14)13-6-7-16(18)17(19)8-13;1-12-7-9-14(10-8-12)16-15(13-5-3-2-4-6-13)20-11-18-19-17(20)21-16;1-12-7-9-13(10-8-12)15-11-19-17(18)16(15)14-5-3-2-4-6-14;1-13-7-9-15(10-8-13)17-12-18-11-16(17)14-5-3-2-4-6-14/h3-13H,1-2H3;4-11H,1-3H3;2-8H,9-10H2,1H3;2-11H,1H3;2-10H,11H2,1H3;2-10H,11-12H2,1H3.

What are the key properties of 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole?

3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole has a molecular weight of 1691.01 g/mol, XLogP of 25.74, 13 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(3,4-difluorophenyl)-4-(4-methylphenyl)-2,5-dihydrofuran;3-(3-fluorophenyl)-5,5-dimethyl-4-(4-methylphenyl)furan-2-one;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;3-(4-methylphenyl)-4-phenyl-2,5-dihydrofuran;3-(4-methylphenyl)-4-phenyl-2H-furan-5-one;6-(4-methylphenyl)-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole is sourced from PubChem (CID 159791549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).