4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol

C127H93ClFN15O11S — CID 159252944

About 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol

4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol (PubChem CID 159252944) has the molecular formula C127H93ClFN15O11S and a molecular weight of 2091.75 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol.

Molecular Properties

• Compound Name: 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol
• PubChem CID: 159252944
• Molecular Formula: C127H93ClFN15O11S
• Molecular Weight: 2091.75 g/mol
• Exact Mass: 2089.66
• IUPAC Name: 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol
• SMILES: COc1ccc(-c2ccc(O)c(-c3cc4cc(C)ccc4[nH]3)c2)cc1.Cc1nc(-c2ccc3[nH]c(-c4cc(-c5ccc(Cl)cc5)ccc4O)cc3c2)no1.Cc1nc(-c2ccc3[nH]c(-c4cc(-c5ccc(F)cc5)ccc4O)cc3c2)no1.Cc1nc(-c2ccc3[nH]c(-c4cc(-c5cccs5)ccc4O)cc3c2)no1.Cc1nc(-c2ccc3[nH]c(-c4ccccc4O)cc3c2)no1.[C-]#[N+]c1ccc2[nH]c(-c3cc(-c4ccccc4)ccc3O)cc2c1
• InChI: InChI=1S/C23H16ClN3O2.C23H16FN3O2.C22H19NO2.C21H15N3O2S.C21H14N2O.C17H13N3O2/c2*1-13-25-23(27-29-13)16-4-8-20-17(10-16)12-21(26-20)19-11-15(5-9-22(19)28)14-2-6-18(24)7-3-14;1-14-3-9-20-17(11-14)13-21(23-20)19-12-16(6-10-22(19)24)15-4-7-18(25-2)8-5-15;1-12-22-21(24-26-12)14-4-6-17-15(9-14)11-18(23-17)16-10-13(5-7-19(16)25)20-3-2-8-27-20;1-22-17-8-9-19-16(11-17)13-20(23-19)18-12-15(7-10-21(18)24)14-5-3-2-4-6-14;1-10-18-17(20-22-10)11-6-7-14-12(8-11)9-15(19-14)13-4-2-3-5-16(13)21/h2*2-12,26,28H,1H3;3-13,23-24H,1-2H3;2-11,23,25H,1H3;2-13,23-24H;2-9,19,21H,1H3
• InChIKey: KVNLSRSELXLYRM-UHFFFAOYSA-N
• XLogP: 32.73
• TPSA: 385.39 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 20
• Rotatable Bonds: 16
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2091.75
LogP ≤ 5	32.73
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol?

The IUPAC name of 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol (CID 159252944) is 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol.

What is the SMILES notation for 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol?

The canonical SMILES for 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol is COc1ccc(-c2ccc(O)c(-c3cc4cc(C)ccc4[nH]3)c2)cc1.Cc1nc(-c2ccc3[nH]c(-c4cc(-c5ccc(Cl)cc5)ccc4O)cc3c2)no1.Cc1nc(-c2ccc3[nH]c(-c4cc(-c5ccc(F)cc5)ccc4O)cc3c2)no1.Cc1nc(-c2ccc3[nH]c(-c4cc(-c5cccs5)ccc4O)cc3c2)no1.Cc1nc(-c2ccc3[nH]c(-c4ccccc4O)cc3c2)no1.[C-]#[N+]c1ccc2[nH]c(-c3cc(-c4ccccc4)ccc3O)cc2c1.

What is the InChIKey of 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol?

The InChIKey is KVNLSRSELXLYRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16ClN3O2.C23H16FN3O2.C22H19NO2.C21H15N3O2S.C21H14N2O.C17H13N3O2/c2*1-13-25-23(27-29-13)16-4-8-20-17(10-16)12-21(26-20)19-11-15(5-9-22(19)28)14-2-6-18(24)7-3-14;1-14-3-9-20-17(11-14)13-21(23-20)19-12-16(6-10-22(19)24)15-4-7-18(25-2)8-5-15;1-12-22-21(24-26-12)14-4-6-17-15(9-14)11-18(23-17)16-10-13(5-7-19(16)25)20-3-2-8-27-20;1-22-17-8-9-19-16(11-17)13-20(23-19)18-12-15(7-10-21(18)24)14-5-3-2-4-6-14;1-10-18-17(20-22-10)11-6-7-14-12(8-11)9-15(19-14)13-4-2-3-5-16(13)21/h2*2-12,26,28H,1H3;3-13,23-24H,1-2H3;2-11,23,25H,1H3;2-13,23-24H;2-9,19,21H,1H3.

What are the key properties of 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol?

4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol has a molecular weight of 2091.75 g/mol, XLogP of 32.73, 16 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4-chlorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;4-(4-fluorophenyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-(5-isocyano-1H-indol-2-yl)-4-phenylphenol;4-(4-methoxyphenyl)-2-(5-methyl-1H-indol-2-yl)phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]phenol;2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-indol-2-yl]-4-thiophen-2-ylphenol is sourced from PubChem (CID 159252944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).