2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione

C180H216N8O12S20Si12 — CID 159905991

About 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione

2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione (PubChem CID 159905991) has the molecular formula C180H216N8O12S20Si12 and a molecular weight of 3662.12 g/mol. Its IUPAC name is 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione.

Molecular Properties

• Compound Name: 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione
• PubChem CID: 159905991
• Molecular Formula: C180H216N8O12S20Si12
• Molecular Weight: 3662.12 g/mol
• Exact Mass: 3656.82
• IUPAC Name: 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione
• SMILES: CC(C)[Si](CCCN1C(=O)C2=C(c3ccc(-c4ccc(-c5cccs5)s4)s3)N(CCC[Si](C(C)C)(C(C)C)C(C)C)C(=O)C2=C1c1ccc(-c2ccc(-c3cccs3)s2)s1)(C(C)C)C(C)C.C[Si](C)(C)CCCN1C(=O)C2=C(c3ccc(-c4ccc(-c5cccs5)s4)s3)N(CCC[Si](C)(C)C)C(=O)C2=C1c1ccc(-c2ccc(-c3cccs3)s2)s1.C[Si](C)(C)O[SiH](CCCN1C(=O)C2=C(c3cccs3)N(CCC[SiH](O[Si](C)(C)C)O[Si](C)(C)C)C(=O)C2=C1c1cccs1)O[Si](C)(C)C.C[Si](C)(CCCN1C(=O)C2=C(c3ccc(-c4ccc(-c5cccs5)s4)s3)N(CCC[Si](C)(C)c3ccccc3)C(=O)C2=C1c1ccc(-c2ccc(-c3cccs3)s2)s1)c1ccccc1
• InChI: InChI=1S/C54H68N2O2S6Si2.C52H48N2O2S6Si2.C42H44N2O2S6Si2.C32H56N2O6S2Si6/c1-33(2)65(34(3)4,35(5)6)31-15-27-55-51(47-25-23-45(63-47)43-21-19-41(61-43)39-17-13-29-59-39)49-50(53(55)57)52(56(54(49)58)28-16-32-66(36(7)8,37(9)10)38(11)12)48-26-24-46(64-48)44-22-20-42(62-44)40-18-14-30-60-40;1-63(2,35-15-7-5-8-16-35)33-13-29-53-49(45-27-25-43(61-45)41-23-21-39(59-41)37-19-11-31-57-37)47-48(51(53)55)50(54(52(47)56)30-14-34-64(3,4)36-17-9-6-10-18-36)46-28-26-44(62-46)42-24-22-40(60-42)38-20-12-32-58-38;1-53(2,3)25-9-21-43-39(35-19-17-33(51-35)31-15-13-29(49-31)27-11-7-23-47-27)37-38(41(43)45)40(44(42(37)46)22-10-26-54(4,5)6)36-20-18-34(52-36)32-16-14-30(50-32)28-12-8-24-48-28;1-45(2,3)37-43(38-46(4,5)6)23-15-19-33-29(25-17-13-21-41-25)27-28(31(33)35)30(26-18-14-22-42-26)34(32(27)36)20-16-24-44(39-47(7,8)9)40-48(10,11)12/h13-14,17-26,29-30,33-38H,15-16,27-28,31-32H2,1-12H3;5-12,15-28,31-32H,13-14,29-30,33-34H2,1-4H3;7-8,11-20,23-24H,9-10,21-22,25-26H2,1-6H3;13-14,17-18,21-22,43-44H,15-16,19-20,23-24H2,1-12H3
• InChIKey: NWOPMBRJEDBFFP-UHFFFAOYSA-N
• XLogP: 55.44
• TPSA: 199.40 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 68
• Heavy Atoms: 232
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3662.12
LogP ≤ 5	55.44
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'ene_five_het_C(85)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione?

The IUPAC name of 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione (CID 159905991) is 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione.

What is the SMILES notation for 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione?

The canonical SMILES for 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione is CC(C)[Si](CCCN1C(=O)C2=C(c3ccc(-c4ccc(-c5cccs5)s4)s3)N(CCC[Si](C(C)C)(C(C)C)C(C)C)C(=O)C2=C1c1ccc(-c2ccc(-c3cccs3)s2)s1)(C(C)C)C(C)C.C[Si](C)(C)CCCN1C(=O)C2=C(c3ccc(-c4ccc(-c5cccs5)s4)s3)N(CCC[Si](C)(C)C)C(=O)C2=C1c1ccc(-c2ccc(-c3cccs3)s2)s1.C[Si](C)(C)O[SiH](CCCN1C(=O)C2=C(c3cccs3)N(CCC[SiH](O[Si](C)(C)C)O[Si](C)(C)C)C(=O)C2=C1c1cccs1)O[Si](C)(C)C.C[Si](C)(CCCN1C(=O)C2=C(c3ccc(-c4ccc(-c5cccs5)s4)s3)N(CCC[Si](C)(C)c3ccccc3)C(=O)C2=C1c1ccc(-c2ccc(-c3cccs3)s2)s1)c1ccccc1.

What is the InChIKey of 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione?

The InChIKey is NWOPMBRJEDBFFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H68N2O2S6Si2.C52H48N2O2S6Si2.C42H44N2O2S6Si2.C32H56N2O6S2Si6/c1-33(2)65(34(3)4,35(5)6)31-15-27-55-51(47-25-23-45(63-47)43-21-19-41(61-43)39-17-13-29-59-39)49-50(53(55)57)52(56(54(49)58)28-16-32-66(36(7)8,37(9)10)38(11)12)48-26-24-46(64-48)44-22-20-42(62-44)40-18-14-30-60-40;1-63(2,35-15-7-5-8-16-35)33-13-29-53-49(45-27-25-43(61-45)41-23-21-39(59-41)37-19-11-31-57-37)47-48(51(53)55)50(54(52(47)56)30-14-34-64(3,4)36-17-9-6-10-18-36)46-28-26-44(62-46)42-24-22-40(60-42)38-20-12-32-58-38;1-53(2,3)25-9-21-43-39(35-19-17-33(51-35)31-15-13-29(49-31)27-11-7-23-47-27)37-38(41(43)45)40(44(42(37)46)22-10-26-54(4,5)6)36-20-18-34(52-36)32-16-14-30(50-32)28-12-8-24-48-28;1-45(2,3)37-43(38-46(4,5)6)23-15-19-33-29(25-17-13-21-41-25)27-28(31(33)35)30(26-18-14-22-42-26)34(32(27)36)20-16-24-44(39-47(7,8)9)40-48(10,11)12/h13-14,17-26,29-30,33-38H,15-16,27-28,31-32H2,1-12H3;5-12,15-28,31-32H,13-14,29-30,33-34H2,1-4H3;7-8,11-20,23-24H,9-10,21-22,25-26H2,1-6H3;13-14,17-18,21-22,43-44H,15-16,19-20,23-24H2,1-12H3.

What are the key properties of 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione?

2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione has a molecular weight of 3662.12 g/mol, XLogP of 55.44, 68 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-bis[3-bis(trimethylsilyloxy)silylpropyl]-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione;2,5-bis[3-[dimethyl(phenyl)silyl]propyl]-1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis(3-trimethylsilylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione;1,4-bis[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2,5-bis[3-tri(propan-2-yl)silylpropyl]pyrrolo[3,4-c]pyrrole-3,6-dione is sourced from PubChem (CID 159905991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).