4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione

C151H112N12O12 — CID 159151046

IUPAC4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione
SMILESCC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc2c1C(=O)N(C(C)(C)N1C(=O)c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3C1=O)C2=O.O=C1c2cccc(-n3c4ccccc4c4ccccc43)c2C(=O)N1c1cccc(N2C(=O)c3cccc(-n4c5ccccc5c5ccccc54)c3C2=O)c1.O=C1c2cccc(-n3c4ccccc4c4ccccc43)c2C(=O)N1c1ccccc1N1C(=O)c2cccc(-n3c4ccccc4c4ccccc43)c2C1=O
InChIInChI=1S/C59H60N4O4.2C46H26N4O4/c1-55(2,3)33-21-25-43-39(29-33)40-30-34(56(4,5)6)22-26-44(40)60(43)47-19-15-17-37-49(47)53(66)62(51(37)64)59(13,14)63-52(65)38-18-16-20-48(50(38)54(63)67)61-45-27-23-35(57(7,8)9)31-41(45)42-32-36(58(10,11)12)24-28-46(42)61;51-43-33-18-10-24-39(49-35-20-5-1-14-29(35)30-15-2-6-21-36(30)49)41(33)45(53)47(43)27-12-9-13-28(26-27)48-44(52)34-19-11-25-40(42(34)46(48)54)50-37-22-7-3-16-31(37)32-17-4-8-23-38(32)50;51-43-31-17-11-25-39(47-33-19-5-1-13-27(33)28-14-2-6-20-34(28)47)41(31)45(53)49(43)37-23-9-10-24-38(37)50-44(52)32-18-12-26-40(42(32)46(50)54)48-35-21-7-3-15-29(35)30-16-4-8-22-36(30)48/h15-32H,1-14H3;2*1-26H
InChIKeyKJHFOEFWNIIKRO-UHFFFAOYSA-N
MW2286.63 g/mol
LogP32.66
Rot. Bonds12

About 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione

4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione (PubChem CID 159151046) has the molecular formula C151H112N12O12 and a molecular weight of 2286.63 g/mol. Its IUPAC name is 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione.

Molecular Properties

Compound Name4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione
PubChem CID159151046
Molecular FormulaC151H112N12O12
Molecular Weight2286.63 g/mol
Exact Mass2284.85
IUPAC Name4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione
SMILESCC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc2c1C(=O)N(C(C)(C)N1C(=O)c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3C1=O)C2=O.O=C1c2cccc(-n3c4ccccc4c4ccccc43)c2C(=O)N1c1cccc(N2C(=O)c3cccc(-n4c5ccccc5c5ccccc54)c3C2=O)c1.O=C1c2cccc(-n3c4ccccc4c4ccccc43)c2C(=O)N1c1ccccc1N1C(=O)c2cccc(-n3c4ccccc4c4ccccc43)c2C1=O
InChIInChI=1S/C59H60N4O4.2C46H26N4O4/c1-55(2,3)33-21-25-43-39(29-33)40-30-34(56(4,5)6)22-26-44(40)60(43)47-19-15-17-37-49(47)53(66)62(51(37)64)59(13,14)63-52(65)38-18-16-20-48(50(38)54(63)67)61-45-27-23-35(57(7,8)9)31-41(45)42-32-36(58(10,11)12)24-28-46(42)61;51-43-33-18-10-24-39(49-35-20-5-1-14-29(35)30-15-2-6-21-36(30)49)41(33)45(53)47(43)27-12-9-13-28(26-27)48-44(52)34-19-11-25-40(42(34)46(48)54)50-37-22-7-3-16-31(37)32-17-4-8-23-38(32)50;51-43-31-17-11-25-39(47-33-19-5-1-13-27(33)28-14-2-6-20-34(28)47)41(31)45(53)49(43)37-23-9-10-24-38(37)50-44(52)32-18-12-26-40(42(32)46(50)54)48-35-21-7-3-15-29(35)30-16-4-8-22-36(30)48/h15-32H,1-14H3;2*1-26H
InChIKeyKJHFOEFWNIIKRO-UHFFFAOYSA-N
XLogP32.66
TPSA253.86 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds12
Heavy Atoms175
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002286.63
LogP ≤ 532.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione?
The IUPAC name of 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione (CID 159151046) is 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione.
What is the SMILES notation for 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione?
The canonical SMILES for 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione is CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc2c1C(=O)N(C(C)(C)N1C(=O)c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3C1=O)C2=O.O=C1c2cccc(-n3c4ccccc4c4ccccc43)c2C(=O)N1c1cccc(N2C(=O)c3cccc(-n4c5ccccc5c5ccccc54)c3C2=O)c1.O=C1c2cccc(-n3c4ccccc4c4ccccc43)c2C(=O)N1c1ccccc1N1C(=O)c2cccc(-n3c4ccccc4c4ccccc43)c2C1=O.
What is the InChIKey of 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione?
The InChIKey is KJHFOEFWNIIKRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H60N4O4.2C46H26N4O4/c1-55(2,3)33-21-25-43-39(29-33)40-30-34(56(4,5)6)22-26-44(40)60(43)47-19-15-17-37-49(47)53(66)62(51(37)64)59(13,14)63-52(65)38-18-16-20-48(50(38)54(63)67)61-45-27-23-35(57(7,8)9)31-41(45)42-32-36(58(10,11)12)24-28-46(42)61;51-43-33-18-10-24-39(49-35-20-5-1-14-29(35)30-15-2-6-21-36(30)49)41(33)45(53)47(43)27-12-9-13-28(26-27)48-44(52)34-19-11-25-40(42(34)46(48)54)50-37-22-7-3-16-31(37)32-17-4-8-23-38(32)50;51-43-31-17-11-25-39(47-33-19-5-1-13-27(33)28-14-2-6-20-34(28)47)41(31)45(53)49(43)37-23-9-10-24-38(37)50-44(52)32-18-12-26-40(42(32)46(50)54)48-35-21-7-3-15-29(35)30-16-4-8-22-36(30)48/h15-32H,1-14H3;2*1-26H.
What are the key properties of 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione?
4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione has a molecular weight of 2286.63 g/mol, XLogP of 32.66, 12 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione is sourced from PubChem (CID 159151046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).