5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione

C112H126N6O25Si8 — CID 160774363

About 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione

5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione (PubChem CID 160774363) has the molecular formula C112H126N6O25Si8 and a molecular weight of 2180.94 g/mol. Its IUPAC name is 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione.

Molecular Properties

• Compound Name: 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione
• PubChem CID: 160774363
• Molecular Formula: C112H126N6O25Si8
• Molecular Weight: 2180.94 g/mol
• Exact Mass: 2178.69
• IUPAC Name: 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione
• SMILES: CCCC[Si]1(C)O[Si](C)(CC)O[Si](C)(CC)O[Si](C)(CCCN2C(=O)c3ccc(C(=O)c4ccc5c(c4)C(=O)N(C)C5=O)cc3C2=O)O1.CCCC[Si]1(C)O[Si](C)(CC)O[Si](C)(CCCN2C(=O)c3ccc(C(=O)c4ccc5c(c4)C(=O)N(C)C5=O)cc3C2=O)O[Si](C)(CC)O1.Cc1ccc(Oc2ccc(C(C)(C)c3ccc(Oc4ccc(N5C(=O)c6ccc(C(=O)c7ccc8c(c7)C(=O)N(C)C8=O)cc6C5=O)cc4)cc3)cc2)cc1
• InChI: InChI=1S/C46H34N2O7.2C33H46N2O9Si4/c1-27-5-15-33(16-6-27)54-34-17-9-30(10-18-34)46(2,3)31-11-19-35(20-12-31)55-36-21-13-32(14-22-36)48-44(52)38-24-8-29(26-40(38)45(48)53)41(49)28-7-23-37-39(25-28)43(51)47(4)42(37)50;1-9-12-19-47(7)41-45(5,10-2)43-48(8,44-46(6,11-3)42-47)20-13-18-35-32(39)26-17-15-24(22-28(26)33(35)40)29(36)23-14-16-25-27(21-23)31(38)34(4)30(25)37;1-9-12-19-47(7)42-45(5,10-2)41-46(6,11-3)43-48(8,44-47)20-13-18-35-32(39)26-17-15-24(22-28(26)33(35)40)29(36)23-14-16-25-27(21-23)31(38)34(4)30(25)37/h5-26H,1-4H3;2*14-17,21-22H,9-13,18-20H2,1-8H3
• InChIKey: RZTAHDQNKQMPGQ-UHFFFAOYSA-N
• XLogP: 21.84
• TPSA: 367.79 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 31
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2180.94
LogP ≤ 5	21.84
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione?

The IUPAC name of 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione (CID 160774363) is 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione.

What is the SMILES notation for 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione?

The canonical SMILES for 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione is CCCC[Si]1(C)O[Si](C)(CC)O[Si](C)(CC)O[Si](C)(CCCN2C(=O)c3ccc(C(=O)c4ccc5c(c4)C(=O)N(C)C5=O)cc3C2=O)O1.CCCC[Si]1(C)O[Si](C)(CC)O[Si](C)(CCCN2C(=O)c3ccc(C(=O)c4ccc5c(c4)C(=O)N(C)C5=O)cc3C2=O)O[Si](C)(CC)O1.Cc1ccc(Oc2ccc(C(C)(C)c3ccc(Oc4ccc(N5C(=O)c6ccc(C(=O)c7ccc8c(c7)C(=O)N(C)C8=O)cc6C5=O)cc4)cc3)cc2)cc1.

What is the InChIKey of 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione?

The InChIKey is RZTAHDQNKQMPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H34N2O7.2C33H46N2O9Si4/c1-27-5-15-33(16-6-27)54-34-17-9-30(10-18-34)46(2,3)31-11-19-35(20-12-31)55-36-21-13-32(14-22-36)48-44(52)38-24-8-29(26-40(38)45(48)53)41(49)28-7-23-37-39(25-28)43(51)47(4)42(37)50;1-9-12-19-47(7)41-45(5,10-2)43-48(8,44-46(6,11-3)42-47)20-13-18-35-32(39)26-17-15-24(22-28(26)33(35)40)29(36)23-14-16-25-27(21-23)31(38)34(4)30(25)37;1-9-12-19-47(7)42-45(5,10-2)41-46(6,11-3)43-48(8,44-47)20-13-18-35-32(39)26-17-15-24(22-28(26)33(35)40)29(36)23-14-16-25-27(21-23)31(38)34(4)30(25)37/h5-26H,1-4H3;2*14-17,21-22H,9-13,18-20H2,1-8H3.

What are the key properties of 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione?

5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione has a molecular weight of 2180.94 g/mol, XLogP of 21.84, 31 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[2-[3-(4-butyl-6,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;5-[2-[3-(6-butyl-4,8-diethyl-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propyl]-1,3-dioxoisoindole-5-carbonyl]-2-methylisoindole-1,3-dione;2-methyl-5-[2-[4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]phenyl]-1,3-dioxoisoindole-5-carbonyl]isoindole-1,3-dione is sourced from PubChem (CID 160774363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).