5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)

C104H70F6N4O8W2 — CID 161054806

About 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)

5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten) (PubChem CID 161054806) has the molecular formula C104H70F6N4O8W2 and a molecular weight of 1985.39 g/mol. Its IUPAC name is 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten).

Molecular Properties

• Compound Name: 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)
• PubChem CID: 161054806
• Molecular Formula: C104H70F6N4O8W2
• Molecular Weight: 1985.39 g/mol
• Exact Mass: 1984.41
• IUPAC Name: 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)
• SMILES: Cc1ccc(-c2cc(-c3ccc(C)cc3)c3cccnc3c2O)cc1.O=[W]=O.O=[W]=O.Oc1c(-c2ccc(C(F)(F)F)cc2)cc(-c2ccc(C(F)(F)F)cc2)c2cccnc12.Oc1c(-c2cccc3ccccc23)cc(-c2cccc3ccccc23)c2cccnc12.Oc1c(-c2cccc3ccccc23)cc(-c2cccc3ccccc23)c2cccnc12
• InChI: InChI=1S/2C29H19NO.C23H13F6NO.C23H19NO.4O.2W/c2*31-29-27(24-15-6-11-20-9-2-4-13-22(20)24)18-26(25-16-7-17-30-28(25)29)23-14-5-10-19-8-1-3-12-21(19)23;24-22(25,26)15-7-3-13(4-8-15)18-12-19(21(31)20-17(18)2-1-11-30-20)14-5-9-16(10-6-14)23(27,28)29;1-15-5-9-17(10-6-15)20-14-21(18-11-7-16(2)8-12-18)23(25)22-19(20)4-3-13-24-22;;;;;;/h2*1-18,31H;1-12,31H;3-14,25H,1-2H3
• InChIKey: MSLXFGWWRDFMLX-UHFFFAOYSA-N
• XLogP: 27.88
• TPSA: 200.76 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 12
• Rotatable Bonds: 8
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1985.39
LogP ≤ 5	27.88
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)?

The IUPAC name of 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten) (CID 161054806) is 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten).

What is the SMILES notation for 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)?

The canonical SMILES for 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten) is Cc1ccc(-c2cc(-c3ccc(C)cc3)c3cccnc3c2O)cc1.O=[W]=O.O=[W]=O.Oc1c(-c2ccc(C(F)(F)F)cc2)cc(-c2ccc(C(F)(F)F)cc2)c2cccnc12.Oc1c(-c2cccc3ccccc23)cc(-c2cccc3ccccc23)c2cccnc12.Oc1c(-c2cccc3ccccc23)cc(-c2cccc3ccccc23)c2cccnc12.

What is the InChIKey of 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)?

The InChIKey is MSLXFGWWRDFMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C29H19NO.C23H13F6NO.C23H19NO.4O.2W/c2*31-29-27(24-15-6-11-20-9-2-4-13-22(20)24)18-26(25-16-7-17-30-28(25)29)23-14-5-10-19-8-1-3-12-21(19)23;24-22(25,26)15-7-3-13(4-8-15)18-12-19(21(31)20-17(18)2-1-11-30-20)14-5-9-16(10-6-14)23(27,28)29;1-15-5-9-17(10-6-15)20-14-21(18-11-7-16(2)8-12-18)23(25)22-19(20)4-3-13-24-22;;;;;;/h2*1-18,31H;1-12,31H;3-14,25H,1-2H3;;;;;;.

What are the key properties of 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)?

5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten) has a molecular weight of 1985.39 g/mol, XLogP of 27.88, 8 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 5,7-bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten) is sourced from PubChem (CID 161054806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).